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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 23:16:40 UTC

Update Date

2022-03-07 02:55:35 UTC

HMDB ID

HMDB0038001

Secondary Accession Numbers

HMDB38001

Metabolite Identification

Common Name

Delphinidin 3-rutinoside

Description

Delphinidin 3-rutinoside belongs to the class of organic compounds known as anthocyanidin-3-o-glycosides. These are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C3-position. Delphinidin 3-rutinoside is found, on average, in the highest concentration within blackcurrants (Ribes nigrum). Delphinidin 3-rutinoside has also been detected, but not quantified in, several different foods, such as ryes (Secale cereale), potatos (Solanum tuberosum), cassavas (Manihot esculenta), bananas (Musa acuminata), and gooseberries (Ribes uva-crispa). This could make delphinidin 3-rutinoside a potential biomarker for the consumption of these foods. Delphinidin 3-rutinoside is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Delphinidin 3-rutinoside.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

Delphinidin 3-O-rutinoside
  Mrv1652309231718202D          

 43 47  0  0  1  0            999 V2000
   -3.5724    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    3.7125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.8579    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    2.4749    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1434    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7145    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2374    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289    2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    2.0625    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.5724    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.0012    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    3.3000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0012    3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  1  0  0  0
  5  6  1  0  0  0  0
  7  6  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  6  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 13 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 11 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  2  0  0  0  0
 23 31  1  0  0  0  0
  9 32  1  0  0  0  0
 32 33  1  1  0  0  0
 32 34  1  0  0  0  0
 34 35  1  6  0  0  0
 34 36  1  0  0  0  0
  7 36  1  0  0  0  0
 36 37  1  1  0  0  0
  4 38  1  0  0  0  0
 38 39  1  6  0  0  0
 38 40  1  0  0  0  0
 40 41  1  6  0  0  0
 40 42  1  0  0  0  0
  2 42  1  0  0  0  0
 42 43  1  1  0  0  0
M  CHG  1  21   1
M  END

HMDB0038001
     RDKit          3D
Delphinidin 3-rutinoside
 74 78  0  0  0  0  0  0  0  0999 V2000
   -4.7039    0.5399    3.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5546   -0.2712    2.2088 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.7556   -0.9533    1.3246 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4402   -0.1942    0.1967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4797   -0.8124   -0.5933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3717   -0.0063   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2594   -0.5648   -1.5251 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2318    0.3291   -1.5006 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9756   -0.1241   -2.0604 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8971   -0.2247   -1.1386 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8027   -0.3201   -0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8378   -1.5435    0.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7543   -1.7622    1.4616 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8012   -2.9636    2.1855 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8643   -3.9472    1.8804 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7224   -3.2112    3.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6324   -2.2028    3.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5718   -2.4421    4.4416 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5973   -1.0235    2.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6706   -0.7773    1.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6315    0.3337    1.0823 O   0  0  0  0  0  3  0  0  0  0  0  0
    3.7615    0.5958    0.1335 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8882    1.9070   -0.4937 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1238    2.5363   -0.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3710    3.7843   -0.8753 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6288    4.3982   -0.7530 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3399    4.4396   -1.5047 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5453    5.7160   -2.0225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0990    3.8622   -1.6375 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0488    4.5473   -2.2861 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    2.6017   -1.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7401   -1.3278   -2.9515 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0522   -0.8874   -4.0776 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0460   -2.4564   -2.2799 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8577   -3.5065   -1.9153 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7852   -1.9179   -1.1223 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8296   -2.8136   -0.8892 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6679    0.0400   -0.6625 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.5248    1.2905   -1.2581 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9088    0.0944    0.2074 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.9059    0.8644   -0.3573 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5382    0.6675    1.5679 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.6557    0.7473    2.3970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0226    1.2210    2.6523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2267   -0.1512    3.8820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4088    1.1803    3.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1371   -1.0195    2.7971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0571    0.7736    0.5351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9267    0.2378    0.3120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6798    0.9510   -1.1377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6882   -0.6687   -2.5578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2015    0.7105   -2.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
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    6.3574   -2.1863    5.4146 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3071   -0.2653    2.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9549    2.0247    0.1139 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3543    3.8728   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4422    6.1589   -1.9379 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2448    5.4540   -2.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310    2.1822   -1.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617   -1.6221   -3.3240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5836   -0.2751   -4.6290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7138   -2.8766   -3.0038 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9279   -4.2360   -2.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1685   -1.8215   -0.2088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5604   -3.7588   -1.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7704   -0.7598   -1.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7396    1.2228   -2.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2922   -0.9290    0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2950    0.4293   -1.1414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1396    1.7016    1.4702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5086    0.6698    1.9175 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 25 27  2  0
 27 28  1  0
 27 29  1  0
 29 30  1  0
 29 31  2  0
  9 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
  4 38  1  0
 38 39  1  0
 38 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  1  0
 42  2  1  0
 36  7  1  0
 22 11  1  0
 31 23  1  0
 20 13  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  1
  4 48  1  1
  6 49  1  0
  6 50  1  0
  7 51  1  6
  9 52  1  6
 12 53  1  0
 15 54  1  0
 16 55  1  0
 18 56  1  0
 19 57  1  0
 24 58  1  0
 26 59  1  0
 28 60  1  0
 30 61  1  0
 31 62  1  0
 32 63  1  6
 33 64  1  0
 34 65  1  6
 35 66  1  0
 36 67  1  1
 37 68  1  0
 38 69  1  6
 39 70  1  0
 40 71  1  1
 41 72  1  0
 42 73  1  6
 43 74  1  0
M  CHG  1  21   1
M  END

Delphinidin 3-O-rutinoside
  Mrv1652309231718202D          

 43 47  0  0  1  0            999 V2000
   -3.5724    4.5375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    3.7125    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.8579    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    2.4749    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1434    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.7145    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.8250    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    2.1434   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -2.4749    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2374    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    1.2374    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.4289    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145    2.0625    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.4289    2.4749    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0000    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5724    2.0625    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.5724    1.2374    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    2.4749    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.0012    2.0625    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2868    3.3000    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -5.0012    3.7125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  1  6  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  1  1  0  0  0
  5  6  1  0  0  0  0
  7  6  1  6  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  6  0  0  0
 10 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 14 16  1  0  0  0  0
 16 17  2  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  2  0  0  0  0
 13 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  2  0  0  0  0
 11 22  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  2  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 25 27  2  0  0  0  0
 27 28  1  0  0  0  0
 27 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 31  2  0  0  0  0
 23 31  1  0  0  0  0
  9 32  1  0  0  0  0
 32 33  1  1  0  0  0
 32 34  1  0  0  0  0
 34 35  1  6  0  0  0
 34 36  1  0  0  0  0
  7 36  1  0  0  0  0
 36 37  1  1  0  0  0
  4 38  1  0  0  0  0
 38 39  1  6  0  0  0
 38 40  1  0  0  0  0
 40 41  1  6  0  0  0
 40 42  1  0  0  0  0
  2 42  1  0  0  0  0
 42 43  1  1  0  0  0
M  CHG  1  21   1
M  END
> <DATABASE_ID>
HMDB0038001

> <DATABASE_NAME>
hmdb

> <SMILES>
C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C27H30O16/c1-8-18(32)21(35)23(37)26(40-8)39-7-17-20(34)22(36)24(38)27(43-17)42-16-6-11-12(29)4-10(28)5-15(11)41-25(16)9-2-13(30)19(33)14(31)3-9/h2-6,8,17-18,20-24,26-27,32,34-38H,7H2,1H3,(H4-,28,29,30,31,33)/p+1/t8-,17+,18-,20+,21+,22-,23+,24+,26+,27+/m0/s1

> <INCHI_KEY>
PLKUTZNSKRWCCA-LTSKFBHWSA-O

> <FORMULA>
C27H31O16

> <MOLECULAR_WEIGHT>
611.5254

> <EXACT_MASS>
611.161209944

> <JCHEM_ACCEPTOR_COUNT>
16

> <JCHEM_ATOM_COUNT>
74

> <JCHEM_AVERAGE_POLARIZABILITY>
57.863929524724284

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
11

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

> <ALOGPS_LOGP>
0.66

> <JCHEM_LOGP>
-0.9285000000000003

> <ALOGPS_LOGS>
-2.74

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
7.293529958438477

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.366609430323523

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6789575975639144

> <JCHEM_POLAR_SURFACE_AREA>
272.59

> <JCHEM_REFRACTIVITY>
149.108

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.16e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0038001
     RDKit          3D
Delphinidin 3-rutinoside
 74 78  0  0  0  0  0  0  0  0999 V2000
   -4.7039    0.5399    3.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5546   -0.2712    2.2088 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.7556   -0.9533    1.3246 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4402   -0.1942    0.1967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4797   -0.8124   -0.5933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3717   -0.0063   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2594   -0.5648   -1.5251 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2318    0.3291   -1.5006 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9756   -0.1241   -2.0604 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8971   -0.2247   -1.1386 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8027   -0.3201   -0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8378   -1.5435    0.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7543   -1.7622    1.4616 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8012   -2.9636    2.1855 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8643   -3.9472    1.8804 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7224   -3.2112    3.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6324   -2.2028    3.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5718   -2.4421    4.4416 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5973   -1.0235    2.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6706   -0.7773    1.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6315    0.3337    1.0823 O   0  0  0  0  0  3  0  0  0  0  0  0
    3.7615    0.5958    0.1335 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8882    1.9070   -0.4937 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1238    2.5363   -0.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3710    3.7843   -0.8753 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6288    4.3982   -0.7530 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3399    4.4396   -1.5047 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5453    5.7160   -2.0225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0990    3.8622   -1.6375 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0488    4.5473   -2.2861 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    2.6017   -1.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7401   -1.3278   -2.9515 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0522   -0.8874   -4.0776 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0460   -2.4564   -2.2799 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8577   -3.5065   -1.9153 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7852   -1.9179   -1.1223 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8296   -2.8136   -0.8892 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6679    0.0400   -0.6625 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.5248    1.2905   -1.2581 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9088    0.0944    0.2074 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.9059    0.8644   -0.3573 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5382    0.6675    1.5679 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.6557    0.7473    2.3970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0226    1.2210    2.6523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2267   -0.1512    3.8820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4088    1.1803    3.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1371   -1.0195    2.7971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0571    0.7736    0.5351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9267    0.2378    0.3120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6798    0.9510   -1.1377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6882   -0.6687   -2.5578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2015    0.7105   -2.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1253   -2.2960    0.2597 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8493   -4.8163    2.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7422   -4.1496    3.7245 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3574   -2.1863    5.4146 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3071   -0.2653    2.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9549    2.0247    0.1139 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3543    3.8728   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4422    6.1589   -1.9379 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2448    5.4540   -2.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310    2.1822   -1.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617   -1.6221   -3.3240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5836   -0.2751   -4.6290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7138   -2.8766   -3.0038 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9279   -4.2360   -2.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1685   -1.8215   -0.2088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5604   -3.7588   -1.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7704   -0.7598   -1.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7396    1.2228   -2.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2922   -0.9290    0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2950    0.4293   -1.1414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1396    1.7016    1.4702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5086    0.6698    1.9175 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 25 27  2  0
 27 28  1  0
 27 29  1  0
 29 30  1  0
 29 31  2  0
  9 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
  4 38  1  0
 38 39  1  0
 38 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  1  0
 42  2  1  0
 36  7  1  0
 22 11  1  0
 31 23  1  0
 20 13  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  1
  4 48  1  1
  6 49  1  0
  6 50  1  0
  7 51  1  6
  9 52  1  6
 12 53  1  0
 15 54  1  0
 16 55  1  0
 18 56  1  0
 19 57  1  0
 24 58  1  0
 26 59  1  0
 28 60  1  0
 30 61  1  0
 31 62  1  0
 32 63  1  6
 33 64  1  0
 34 65  1  6
 35 66  1  0
 36 67  1  1
 37 68  1  0
 38 69  1  6
 39 70  1  0
 40 71  1  1
 41 72  1  0
 42 73  1  6
 43 74  1  0
M  CHG  1  21   1
M  END

HEADER    PROTEIN                                 23-SEP-17   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: Delphinidin 3-O-rutinoside                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   23-SEP-17         0                                  
HETATM    1  C   UNK     0      -6.668   8.470   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -6.668   6.930   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      -5.335   6.160   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      -5.335   4.620   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0      -4.001   3.850   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -2.667   4.620   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.334   3.850   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0       0.000   1.540   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0       0.000   0.000   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       2.667   0.000   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0       5.335   1.540   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.668  -2.310   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0       8.002  -3.080   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0       5.335  -3.080   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       2.667  -3.080   0.000  0.00  0.00           O+1
HETATM   22  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       0.000  -4.620   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -1.334  -5.390   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -1.334  -6.930   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      -2.667  -4.620   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      -4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0      -2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0      -4.001  -2.310   0.000  0.00  0.00           O+0
HETATM   31  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   32  C   UNK     0       1.334   2.310   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0       2.667   1.540   0.000  0.00  0.00           O+0
HETATM   34  C   UNK     0       1.334   3.850   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0       2.667   4.620   0.000  0.00  0.00           O+0
HETATM   36  C   UNK     0       0.000   4.620   0.000  0.00  0.00           C+0
HETATM   37  O   UNK     0       0.000   6.160   0.000  0.00  0.00           O+0
HETATM   38  C   UNK     0      -6.668   3.850   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0      -6.668   2.310   0.000  0.00  0.00           O+0
HETATM   40  C   UNK     0      -8.002   4.620   0.000  0.00  0.00           C+0
HETATM   41  O   UNK     0      -9.336   3.850   0.000  0.00  0.00           O+0
HETATM   42  C   UNK     0      -8.002   6.160   0.000  0.00  0.00           C+0
HETATM   43  O   UNK     0      -9.336   6.930   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   42                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   38                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8   36                                                  
CONECT    8    7    9                                                       
CONECT    9    8   10   32                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   22                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14   20                                                  
CONECT   14   13   15   16                                                  
CONECT   15   14                                                            
CONECT   16   14   17                                                       
CONECT   17   16   18   19                                                  
CONECT   18   17                                                            
CONECT   19   17   20                                                       
CONECT   20   19   13   21                                                  
CONECT   21   20   22                                                       
CONECT   22   21   11   23                                                  
CONECT   23   22   24   31                                                  
CONECT   24   23   25                                                       
CONECT   25   24   26   27                                                  
CONECT   26   25                                                            
CONECT   27   25   28   29                                                  
CONECT   28   27                                                            
CONECT   29   27   30   31                                                  
CONECT   30   29                                                            
CONECT   31   29   23                                                       
CONECT   32    9   33   34                                                  
CONECT   33   32                                                            
CONECT   34   32   35   36                                                  
CONECT   35   34                                                            
CONECT   36   34    7   37                                                  
CONECT   37   36                                                            
CONECT   38    4   39   40                                                  
CONECT   39   38                                                            
CONECT   40   38   41   42                                                  
CONECT   41   40                                                            
CONECT   42   40    2   43                                                  
CONECT   43   42                                                            
MASTER        0    0    0    0    0    0    0    0   43    0   94    0
END

COMPND    HMDB0038001
HETATM    1  C1  UNL     1      -4.704   0.540   3.161  1.00  0.00           C  
HETATM    2  C2  UNL     1      -5.555  -0.271   2.209  1.00  0.00           C  
HETATM    3  O1  UNL     1      -4.756  -0.953   1.325  1.00  0.00           O  
HETATM    4  C3  UNL     1      -4.440  -0.194   0.197  1.00  0.00           C  
HETATM    5  O2  UNL     1      -3.480  -0.812  -0.593  1.00  0.00           O  
HETATM    6  C4  UNL     1      -2.372  -0.006  -0.672  1.00  0.00           C  
HETATM    7  C5  UNL     1      -1.259  -0.565  -1.525  1.00  0.00           C  
HETATM    8  O3  UNL     1      -0.232   0.329  -1.501  1.00  0.00           O  
HETATM    9  C6  UNL     1       0.976  -0.124  -2.060  1.00  0.00           C  
HETATM   10  O4  UNL     1       1.897  -0.225  -1.139  1.00  0.00           O  
HETATM   11  C7  UNL     1       2.803  -0.320  -0.235  1.00  0.00           C  
HETATM   12  C8  UNL     1       2.838  -1.543   0.492  1.00  0.00           C  
HETATM   13  C9  UNL     1       3.754  -1.762   1.462  1.00  0.00           C  
HETATM   14  C10 UNL     1       3.801  -2.964   2.186  1.00  0.00           C  
HETATM   15  O5  UNL     1       2.864  -3.947   1.880  1.00  0.00           O  
HETATM   16  C11 UNL     1       4.722  -3.211   3.174  1.00  0.00           C  
HETATM   17  C12 UNL     1       5.632  -2.203   3.441  1.00  0.00           C  
HETATM   18  O6  UNL     1       6.572  -2.442   4.442  1.00  0.00           O  
HETATM   19  C13 UNL     1       5.597  -1.024   2.740  1.00  0.00           C  
HETATM   20  C14 UNL     1       4.671  -0.777   1.747  1.00  0.00           C  
HETATM   21  O7  UNL     1       4.631   0.334   1.082  1.00  0.00           O1+
HETATM   22  C15 UNL     1       3.761   0.596   0.134  1.00  0.00           C  
HETATM   23  C16 UNL     1       3.888   1.907  -0.494  1.00  0.00           C  
HETATM   24  C17 UNL     1       5.124   2.536  -0.385  1.00  0.00           C  
HETATM   25  C18 UNL     1       5.371   3.784  -0.875  1.00  0.00           C  
HETATM   26  O8  UNL     1       6.629   4.398  -0.753  1.00  0.00           O  
HETATM   27  C19 UNL     1       4.340   4.440  -1.505  1.00  0.00           C  
HETATM   28  O9  UNL     1       4.545   5.716  -2.023  1.00  0.00           O  
HETATM   29  C20 UNL     1       3.099   3.862  -1.637  1.00  0.00           C  
HETATM   30  O10 UNL     1       2.049   4.547  -2.286  1.00  0.00           O  
HETATM   31  C21 UNL     1       2.904   2.602  -1.124  1.00  0.00           C  
HETATM   32  C22 UNL     1       0.740  -1.328  -2.952  1.00  0.00           C  
HETATM   33  O11 UNL     1       0.052  -0.887  -4.078  1.00  0.00           O  
HETATM   34  C23 UNL     1       0.046  -2.456  -2.280  1.00  0.00           C  
HETATM   35  O12 UNL     1       0.858  -3.507  -1.915  1.00  0.00           O  
HETATM   36  C24 UNL     1      -0.785  -1.918  -1.122  1.00  0.00           C  
HETATM   37  O13 UNL     1      -1.830  -2.814  -0.889  1.00  0.00           O  
HETATM   38  C25 UNL     1      -5.668   0.040  -0.663  1.00  0.00           C  
HETATM   39  O14 UNL     1      -5.525   1.291  -1.258  1.00  0.00           O  
HETATM   40  C26 UNL     1      -6.909   0.094   0.207  1.00  0.00           C  
HETATM   41  O15 UNL     1      -7.906   0.864  -0.357  1.00  0.00           O  
HETATM   42  C27 UNL     1      -6.538   0.667   1.568  1.00  0.00           C  
HETATM   43  O16 UNL     1      -7.656   0.747   2.397  1.00  0.00           O  
HETATM   44  H1  UNL     1      -4.023   1.221   2.652  1.00  0.00           H  
HETATM   45  H2  UNL     1      -4.227  -0.151   3.882  1.00  0.00           H  
HETATM   46  H3  UNL     1      -5.409   1.180   3.769  1.00  0.00           H  
HETATM   47  H4  UNL     1      -6.137  -1.020   2.797  1.00  0.00           H  
HETATM   48  H5  UNL     1      -4.057   0.774   0.535  1.00  0.00           H  
HETATM   49  H6  UNL     1      -1.927   0.238   0.312  1.00  0.00           H  
HETATM   50  H7  UNL     1      -2.680   0.951  -1.138  1.00  0.00           H  
HETATM   51  H8  UNL     1      -1.688  -0.669  -2.558  1.00  0.00           H  
HETATM   52  H9  UNL     1       1.201   0.710  -2.807  1.00  0.00           H  
HETATM   53  H10 UNL     1       2.125  -2.296   0.260  1.00  0.00           H  
HETATM   54  H11 UNL     1       2.849  -4.816   2.359  1.00  0.00           H  
HETATM   55  H12 UNL     1       4.742  -4.150   3.725  1.00  0.00           H  
HETATM   56  H13 UNL     1       6.357  -2.186   5.415  1.00  0.00           H  
HETATM   57  H14 UNL     1       6.307  -0.265   2.964  1.00  0.00           H  
HETATM   58  H15 UNL     1       5.955   2.025   0.114  1.00  0.00           H  
HETATM   59  H16 UNL     1       7.354   3.873  -0.281  1.00  0.00           H  
HETATM   60  H17 UNL     1       5.442   6.159  -1.938  1.00  0.00           H  
HETATM   61  H18 UNL     1       2.245   5.454  -2.637  1.00  0.00           H  
HETATM   62  H19 UNL     1       1.931   2.182  -1.191  1.00  0.00           H  
HETATM   63  H20 UNL     1       1.762  -1.622  -3.324  1.00  0.00           H  
HETATM   64  H21 UNL     1       0.584  -0.275  -4.629  1.00  0.00           H  
HETATM   65  H22 UNL     1      -0.714  -2.877  -3.004  1.00  0.00           H  
HETATM   66  H23 UNL     1       0.928  -4.236  -2.562  1.00  0.00           H  
HETATM   67  H24 UNL     1      -0.169  -1.821  -0.209  1.00  0.00           H  
HETATM   68  H25 UNL     1      -1.560  -3.759  -1.045  1.00  0.00           H  
HETATM   69  H26 UNL     1      -5.770  -0.760  -1.411  1.00  0.00           H  
HETATM   70  H27 UNL     1      -5.740   1.223  -2.223  1.00  0.00           H  
HETATM   71  H28 UNL     1      -7.292  -0.929   0.403  1.00  0.00           H  
HETATM   72  H29 UNL     1      -8.295   0.429  -1.141  1.00  0.00           H  
HETATM   73  H30 UNL     1      -6.140   1.702   1.470  1.00  0.00           H  
HETATM   74  H31 UNL     1      -8.509   0.670   1.918  1.00  0.00           H  
CONECT    1    2   44   45   46
CONECT    2    3   42   47
CONECT    3    4
CONECT    4    5   38   48
CONECT    5    6
CONECT    6    7   49   50
CONECT    7    8   36   51
CONECT    8    9
CONECT    9   10   32   52
CONECT   10   11
CONECT   11   12   12   22
CONECT   12   13   53
CONECT   13   14   14   20
CONECT   14   15   16
CONECT   15   54
CONECT   16   17   17   55
CONECT   17   18   19
CONECT   18   56
CONECT   19   20   20   57
CONECT   20   21
CONECT   21   22   22
CONECT   22   23
CONECT   23   24   24   31
CONECT   24   25   58
CONECT   25   26   27   27
CONECT   26   59
CONECT   27   28   29
CONECT   28   60
CONECT   29   30   31   31
CONECT   30   61
CONECT   31   62
CONECT   32   33   34   63
CONECT   33   64
CONECT   34   35   36   65
CONECT   35   66
CONECT   36   37   67
CONECT   37   68
CONECT   38   39   40   69
CONECT   39   70
CONECT   40   41   42   71
CONECT   41   72
CONECT   42   43   73
CONECT   43   74
END

HMDB0038001
     RDKit          3D
Delphinidin 3-rutinoside
 74 78  0  0  0  0  0  0  0  0999 V2000
   -4.7039    0.5399    3.1614 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5546   -0.2712    2.2088 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.7556   -0.9533    1.3246 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4402   -0.1942    0.1967 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4797   -0.8124   -0.5933 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3717   -0.0063   -0.6715 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2594   -0.5648   -1.5251 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.2318    0.3291   -1.5006 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9756   -0.1241   -2.0604 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.8971   -0.2247   -1.1386 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8027   -0.3201   -0.2348 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8378   -1.5435    0.4920 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7543   -1.7622    1.4616 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8012   -2.9636    2.1855 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8643   -3.9472    1.8804 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7224   -3.2112    3.1741 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6324   -2.2028    3.4409 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5718   -2.4421    4.4416 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5973   -1.0235    2.7402 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6706   -0.7773    1.7475 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6315    0.3337    1.0823 O   0  0  0  0  0  3  0  0  0  0  0  0
    3.7615    0.5958    0.1335 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8882    1.9070   -0.4937 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1238    2.5363   -0.3848 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3710    3.7843   -0.8753 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6288    4.3982   -0.7530 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3399    4.4396   -1.5047 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5453    5.7160   -2.0225 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.0990    3.8622   -1.6375 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0488    4.5473   -2.2861 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    2.6017   -1.1236 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7401   -1.3278   -2.9515 C   0  0  2  0  0  0  0  0  0  0  0  0
    0.0522   -0.8874   -4.0776 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0460   -2.4564   -2.2799 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8577   -3.5065   -1.9153 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7852   -1.9179   -1.1223 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.8296   -2.8136   -0.8892 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6679    0.0400   -0.6625 C   0  0  2  0  0  0  0  0  0  0  0  0
   -5.5248    1.2905   -1.2581 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9088    0.0944    0.2074 C   0  0  2  0  0  0  0  0  0  0  0  0
   -7.9059    0.8644   -0.3573 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5382    0.6675    1.5679 C   0  0  1  0  0  0  0  0  0  0  0  0
   -7.6557    0.7473    2.3970 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0226    1.2210    2.6523 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2267   -0.1512    3.8820 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4088    1.1803    3.7688 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1371   -1.0195    2.7971 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0571    0.7736    0.5351 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9267    0.2378    0.3120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6798    0.9510   -1.1377 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6882   -0.6687   -2.5578 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2015    0.7105   -2.8073 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1253   -2.2960    0.2597 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8493   -4.8163    2.3592 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7422   -4.1496    3.7245 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3574   -2.1863    5.4146 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3071   -0.2653    2.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9549    2.0247    0.1139 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3543    3.8728   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4422    6.1589   -1.9379 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2448    5.4540   -2.6375 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9310    2.1822   -1.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7617   -1.6221   -3.3240 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5836   -0.2751   -4.6290 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7138   -2.8766   -3.0038 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9279   -4.2360   -2.5618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1685   -1.8215   -0.2088 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5604   -3.7588   -1.0453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7704   -0.7598   -1.4110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7396    1.2228   -2.2227 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2922   -0.9290    0.4027 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2950    0.4293   -1.1414 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1396    1.7016    1.4702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.5086    0.6698    1.9175 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  2  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 17 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  2  0
 22 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  1  0
 25 27  2  0
 27 28  1  0
 27 29  1  0
 29 30  1  0
 29 31  2  0
  9 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
  4 38  1  0
 38 39  1  0
 38 40  1  0
 40 41  1  0
 40 42  1  0
 42 43  1  0
 42  2  1  0
 36  7  1  0
 22 11  1  0
 31 23  1  0
 20 13  1  0
  1 44  1  0
  1 45  1  0
  1 46  1  0
  2 47  1  1
  4 48  1  1
  6 49  1  0
  6 50  1  0
  7 51  1  6
  9 52  1  6
 12 53  1  0
 15 54  1  0
 16 55  1  0
 18 56  1  0
 19 57  1  0
 24 58  1  0
 26 59  1  0
 28 60  1  0
 30 61  1  0
 31 62  1  0
 32 63  1  6
 33 64  1  0
 34 65  1  6
 35 66  1  0
 36 67  1  1
 37 68  1  0
 38 69  1  6
 39 70  1  0
 40 71  1  1
 41 72  1  0
 42 73  1  6
 43 74  1  0
M  CHG  1  21   1
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Delphinidin 3-O-rutinoside	Kegg
Delphinidin 3-rhamnosyl-glucoside	HMDB

Chemical Formula

C₂₇H₃₁O₁₆

Average Molecular Weight

611.5254

Monoisotopic Molecular Weight

611.161209944

IUPAC Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

Traditional Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-({[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-1lambda4-chromen-1-ylium

CAS Registry Number

15674-58-5

SMILES

C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O

InChI Identifier

InChI=1S/C27H30O16/c1-8-18(32)21(35)23(37)26(40-8)39-7-17-20(34)22(36)24(38)27(43-17)42-16-6-11-12(29)4-10(28)5-15(11)41-25(16)9-2-13(30)19(33)14(31)3-9/h2-6,8,17-18,20-24,26-27,32,34-38H,7H2,1H3,(H4-,28,29,30,31,33)/p+1/t8-,17+,18-,20+,21+,22-,23+,24+,26+,27+/m0/s1

InChI Key

PLKUTZNSKRWCCA-LTSKFBHWSA-O

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as anthocyanidin-3-o-glycosides. These are phenolic compounds containing one anthocyanidin moiety which is O-glycosidically linked to a carbohydrate moiety at the C3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Anthocyanidin-3-O-glycosides

Alternative Parents

Substituents

Anthocyanidin-3-o-glycoside
Flavonoid-3-o-glycoside
Hydroxyflavonoid
3'-hydroxyflavonoid
4'-hydroxyflavonoid
7-hydroxyflavonoid
5-hydroxyflavonoid
Anthocyanidin
O-glycosyl compound
Glycosyl compound
Disaccharide
1-benzopyran
Benzopyran
Benzenetriol
Pyrogallol derivative
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Phenol
Monocyclic benzene moiety
Benzenoid
Oxane
Heteroaromatic compound
Secondary alcohol
Organoheterocyclic compound
Oxacycle
Polyol
Acetal
Hydrocarbon derivative
Organic oxygen compound
Alcohol
Organooxygen compound
Organic cation
Aromatic heteropolycyclic compound

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

anthocyanidin glycoside (CHEBI:80441 )
Anthocyanidins (C16315 )
Anthocyanidins and anthocyanins (C16315 )

Ontology

Not Available

Urine (HMDB: HMDB0038001)

Excreta

Biofluid or Excreta

Urine (PMID: 14705874)

Cellular substructure

Extracellular (HMDB: HMDB0038001)
Cytoplasm (HMDB: HMDB0038001)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0038001)

Source

Exogenous

Food

Food (HMDB: HMDB0038001)

Vegetable

Fruit vegetable

Eggplant (FooDB: FOOD00174)

Tuber

Cassava (FooDB: FOOD00323)
Potato (FooDB: FOOD00175)

Fruit

Tropical fruit

Banana (FooDB: FOOD00208)

Berry

Rubus (Blackberry, Raspberry) (FooDB: FOOD00160)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Strawberry (FooDB: FOOD00083)
Red raspberry (FooDB: FOOD00162)
Black elderberry (FooDB: FOOD00166)
Black chokeberry (FooDB: FOOD00136)
Lowbush blueberry (FooDB: FOOD00189)

Drupe

Sweet cherry (FooDB: FOOD00145)

Herb and spice

Oilseed crop

Flaxseed (FooDB: FOOD00101)

Cereal and cereal product

Cereal

Rye (FooDB: FOOD00169)

Endogenous

Plant

Plant (HMDB: HMDB0038001)
Poaceae (HMDB: HMDB0038001)

Not Available

Nutrient (HMDB: HMDB0038001)

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	696.6 mg/L @ 25 °C (est)	The Good Scents Company Information System
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	1.16 g/L	ALOGPS
logP	0.66	ALOGPS
logP	-0.93	ChemAxon
logS	-2.7	ALOGPS
pKa (Strongest Acidic)	6.37	ChemAxon
pKa (Strongest Basic)	-3.7	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	16	ChemAxon
Hydrogen Donor Count	11	ChemAxon
Polar Surface Area	272.59 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	149.11 m³·mol⁻¹	ChemAxon
Polarizability	57.86 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	230.453	30932474
DeepCCS	[M-H]-	228.29	30932474
DeepCCS	[M-2H]-	262.119	30932474
DeepCCS	[M+Na]+	236.531	30932474
AllCCS	[M+H]+	232.3	32859911
AllCCS	[M+H-H2O]+	231.1	32859911
AllCCS	[M+NH4]+	233.4	32859911
AllCCS	[M+Na]+	233.7	32859911
AllCCS	[M-H]-	227.8	32859911
AllCCS	[M+Na-2H]-	230.0	32859911
AllCCS	[M+HCOO]-	232.6	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Delphinidin 3-rutinoside	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	7579.3	Standard polar	33892256
Delphinidin 3-rutinoside	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5275.6	Standard non polar	33892256
Delphinidin 3-rutinoside	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5585.5	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Delphinidin 3-rutinoside,1TMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5347.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5332.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5366.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5321.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5273.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5345.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5331.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5342.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5362.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5334.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5225.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5181.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #11	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5151.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #12	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5237.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #13	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5224.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #14	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5238.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #15	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5243.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #16	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5223.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #17	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5229.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #18	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5189.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #19	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5142.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5182.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #20	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5191.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #21	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5177.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #22	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5194.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #23	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5191.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #24	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5168.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #25	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5184.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #26	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5151.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #27	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5134.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #28	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5155.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #29	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5148.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5153.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #30	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5124.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #31	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5143.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #32	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5214.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #33	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5218.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #34	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5228.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #35	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5213.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #36	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5220.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #37	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5220.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #38	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5215.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #39	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5201.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5231.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #40	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5209.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #41	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5228.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #42	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5214.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #43	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5220.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #44	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5223.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #45	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5223.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #46	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5211.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5217.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5232.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5235.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5215.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5222.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4992.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4985.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #100	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4983.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #101	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4962.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #102	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4932.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #103	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4963.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #104	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4995.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #105	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4968.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #106	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4995.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #107	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4983.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #108	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4987.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #109	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4968.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #11	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5015.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #110	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5102.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #111	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5089.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #112	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5071.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #113	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5082.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #114	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5108.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #115	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5094.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #116	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5103.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #117	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5099.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #118	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5104.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #119	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5084.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #12	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4986.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #120	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5098.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #121	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5079.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #122	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5090.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #123	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5079.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #124	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5089.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #125	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5067.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #126	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5098.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #127	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5103.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #128	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5085.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #129	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5092.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #13	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5024.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #14	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5014.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #15	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4987.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #16	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5017.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #17	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4975.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #18	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4937.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #19	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4978.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4971.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #20	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4965.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #21	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4935.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #22	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4974.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #23	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5064.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #24	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5081.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #25	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5083.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #26	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5064.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #27	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5078.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #28	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5076.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #29	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5064.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5061.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #30	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5043.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #31	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5060.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #32	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5088.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #33	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5068.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #34	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5082.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #35	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5077.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #36	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5075.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #37	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5061.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #38	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5002.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #39	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4983.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5043.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #40	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5013.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #41	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4989.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #42	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5021.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #43	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5017.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #44	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4990.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #45	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5018.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #46	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4969.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #47	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4936.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #48	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4974.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #49	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4964.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5066.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #50	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4934.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #51	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4970.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #52	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5076.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #53	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5091.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #54	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5095.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #55	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5074.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #56	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5088.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #57	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5092.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #58	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5076.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #59	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5055.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5067.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #60	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5072.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #61	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5099.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #62	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5079.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #63	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5093.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #64	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5097.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #65	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5093.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #66	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5079.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #67	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5022.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #68	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5012.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #69	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4989.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5043.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #70	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5020.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #71	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5016.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #72	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4990.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #73	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5018.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #74	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4985.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #75	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4957.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #76	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4992.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #77	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4983.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #78	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4958.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #79	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4989.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5062.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #80	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5020.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #81	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5040.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #82	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5038.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #83	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5016.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #84	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5035.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #85	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5033.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #86	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5020.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #87	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4995.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #88	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5019.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #89	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5043.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5007.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #90	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5021.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #91	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5041.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #92	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5036.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #93	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5037.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #94	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5020.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #95	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4972.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #96	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4993.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #97	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4989.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #98	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4963.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,3TMS,isomer #99	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4990.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4893.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4832.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #100	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4869.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #101	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4852.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #102	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4878.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #103	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4878.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #104	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4848.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #105	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4882.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #106	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4896.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #107	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4919.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #108	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4925.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #109	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4886.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #11	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4861.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #110	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4923.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #111	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4905.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #112	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4887.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #113	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4850.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #114	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4889.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #115	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4926.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #116	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4887.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #117	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4925.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #118	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4923.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #119	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4933.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #12	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4860.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #120	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4906.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #121	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4846.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #122	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4869.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #123	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4853.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #124	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4819.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #125	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4852.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #126	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4860.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #127	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4825.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #128	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4793.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #129	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4828.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #13	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4828.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #130	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4862.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #131	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4828.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #132	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4862.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #133	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4861.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #134	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4866.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #135	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4843.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #136	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5024.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #137	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5006.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #138	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4978.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #139	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5002.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #14	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4863.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #140	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5029.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #141	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5004.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #142	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5028.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #143	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5020.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #144	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5028.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #145	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5006.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #146	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5019.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #147	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4990.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #148	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5014.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #149	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4989.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #15	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4952.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #150	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4996.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #151	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4975.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #152	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5023.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #153	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5032.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #154	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5011.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #155	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5029.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #156	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4912.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #157	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4888.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #158	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4916.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #159	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4931.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #16	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4975.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #160	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4892.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #161	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4931.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #162	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4886.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #163	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4910.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #164	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4917.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #165	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4878.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #166	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4913.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #167	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4895.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #168	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4880.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #169	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4841.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #17	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4982.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #170	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4881.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #171	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4919.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #172	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4881.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #173	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4918.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #174	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4918.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #175	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4926.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #176	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4900.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #177	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4864.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #178	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4887.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #179	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4891.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #18	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4950.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #180	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4855.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #181	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4891.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #182	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4869.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #183	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4857.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #184	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4820.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #185	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4859.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #186	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4894.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #187	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4856.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #188	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4895.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #189	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4892.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #19	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4982.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #190	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4902.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #191	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4876.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #192	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4960.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #193	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4937.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #194	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4908.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #195	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4936.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #196	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4963.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #197	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4938.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #198	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4966.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #199	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4954.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4880.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #20	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4967.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #200	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4963.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #201	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4941.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #202	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4950.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #203	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4920.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #204	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4949.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #205	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4920.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #206	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4932.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #207	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4908.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #208	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4957.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #209	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4968.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #21	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4951.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #210	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4947.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #211	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4969.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #212	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4904.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #213	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4871.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #214	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4835.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #215	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4872.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #216	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4900.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #217	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4863.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #218	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4901.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #219	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4889.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #22	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4917.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #220	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4899.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #221	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4874.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #222	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4882.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #223	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4844.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #224	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4881.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #225	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4849.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #226	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4863.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #227	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4835.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #228	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4890.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #229	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4903.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #23	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4955.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #230	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4878.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #231	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4912.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #232	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5049.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #233	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	5032.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #234	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5046.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #235	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5018.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #236	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5025.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #237	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5008.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #238	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5038.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #239	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5046.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #24	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4986.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #240	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5034.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #241	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5044.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #242	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5032.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #243	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5043.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #244	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5024.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #245	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5020.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #246	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5048.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #25	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4955.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #26	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4987.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #27	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4975.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #28	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4982.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #29	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4959.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4874.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #30	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4906.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #31	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4859.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #32	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4839.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #33	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4870.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #34	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4871.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #35	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4835.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #36	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4871.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #37	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4845.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #38	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4828.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #39	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4854.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4854.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #40	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4857.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #41	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4824.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #42	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4858.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #43	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4875.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #44	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4900.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #45	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4904.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #46	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4865.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #47	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4902.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #48	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4883.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #49	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4866.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4886.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #50	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4832.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #51	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4869.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #52	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4905.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #53	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4868.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #54	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4905.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #55	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4902.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #56	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4913.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #57	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4885.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #58	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4823.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #59	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4846.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4886.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #60	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4830.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #61	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4794.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #62	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4828.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #63	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4833.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #64	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4802.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #65	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4768.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #66	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4802.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #67	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4839.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #68	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4803.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #69	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4839.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4850.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #70	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4837.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #71	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4841.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #72	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4819.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #73	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5001.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #74	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4981.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #75	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4955.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #76	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4978.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #77	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	5004.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #78	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4982.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #79	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	5005.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4887.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #80	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4995.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #81	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5004.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #82	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4980.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #83	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4992.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #84	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4967.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #85	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4990.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #86	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	4966.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #87	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	4976.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #88	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4953.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #89	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O	5000.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4850.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #90	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C	5010.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #91	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	4988.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #92	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	5004.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #93	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4931.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #94	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4879.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #95	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	4860.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #96	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C)[C@H](O)[C@H](O)[C@H]1O	4891.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #97	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O	4890.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #98	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O	4856.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,4TMS,isomer #99	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C)C=C4[O+]=C3C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C	4890.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5544.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5542.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5559.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5526.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5519.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5542.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5529.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5537.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5560.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,1TBDMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5533.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #1	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5573.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #10	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5547.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #11	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5551.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #12	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5595.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #13	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5571.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #14	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5587.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #15	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5597.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #16	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5569.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #17	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5596.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #18	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5552.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #19	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5534.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #2	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5536.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #20	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5550.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #21	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5529.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #22	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5546.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #23	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5554.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #24	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5519.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #25	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5555.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #26	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5536.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #27	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5512.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #28	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5527.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #29	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5529.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #3	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5540.0	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #30	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5501.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #31	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5538.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #32	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5596.3	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #33	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5593.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #34	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5607.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #35	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5583.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #36	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5607.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #37	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5599.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #38	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5590.9	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #39	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5566.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #4	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5578.2	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #40	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5591.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #41	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5598.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #42	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5574.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #43	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5597.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #44	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5604.6	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #45	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5611.7	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #46	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	5591.4	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #5	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O	5555.1	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #6	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H](O)[C@H]1O	5570.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #7	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O	5581.8	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #8	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	5550.5	Semi standard non polar	33892256
Delphinidin 3-rutinoside,2TBDMS,isomer #9	C[C@@H]1O[C@@H](OC[C@H]2O[C@@H](OC3=CC4=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C4[O+]=C3C3=CC(O)=C(O)C(O)=C3)[C@H](O)[C@@H](O)[C@@H]2O)[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	5580.7	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-0006-7290080000-389242df57a220b7e05d	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_1) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-rutinoside GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-QTOF , negative-QTOF	splash10-0pb9-0008009000-da50664ccc99574542b5	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-QTOF , negative-QTOF	splash10-0udi-0009000000-06dd4eb8d0b165f1f55f	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-03di-0000009000-538b87e504fb98a67666	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0f6t-0008900000-dda365a62acf8edd9888	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009000000-8d90d5a29443a5636f95	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-03di-0000309000-65470cb495e2f16536a9	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009000000-e46aea6d0ae527edf9f3	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009100000-9f157dd28479031dbb5a	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009000000-6d7eb80c28d75c63d301	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009000000-48d926ac2b7178822087	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0udi-0009000000-97c996a33fe11648d9b0	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-ITFT , positive-QTOF	splash10-0002-0001902000-9efb8106152232e6b81d	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-rutinoside LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009002000-ac2c38f3faa572f1dd75	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 10V, Positive-QTOF	splash10-03di-0201009000-9734edbe289475bf632c	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 20V, Positive-QTOF	splash10-0a4j-1911027000-05ad9f9052f97f6627b6	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 40V, Positive-QTOF	splash10-06rb-6911000000-b9b1b75110d9d6127892	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 10V, Negative-QTOF	splash10-03di-4421009000-bbb7510141a8a0be93f1	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 20V, Negative-QTOF	splash10-08fs-5911002000-d560b616b894c71ffb4b	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 40V, Negative-QTOF	splash10-0btd-9520000000-94c0f30ccb75b62cde32	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 10V, Positive-QTOF	splash10-0cdi-0109736000-717e08b743f268a5acd6	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 20V, Positive-QTOF	splash10-0a4i-0229332000-0b861b7b69daaf2b9d3c	2021-09-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-rutinoside 40V, Positive-QTOF	splash10-0zg3-5579310000-53a53074798f69e7ecdf	2021-09-25	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 49	14705874	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 49	12592675	details

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Tulipanin

METLIN ID

Not Available

PubChem Compound

5492231

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

rw1701171

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Delphinidin 3-rutinoside (HMDB0038001)

MOL for HMDB0038001 (Delphinidin 3-rutinoside)

3D MOL for HMDB0038001 (Delphinidin 3-rutinoside)

3D SDF for HMDB0038001 (Delphinidin 3-rutinoside)

3D-SDF for HMDB0038001 (Delphinidin 3-rutinoside)

PDB for HMDB0038001 (Delphinidin 3-rutinoside)

3D PDB for HMDB0038001 (Delphinidin 3-rutinoside)

SMILES for HMDB0038001 (Delphinidin 3-rutinoside)

INCHI for HMDB0038001 (Delphinidin 3-rutinoside)

Structure for HMDB0038001 (Delphinidin 3-rutinoside)

3D Structure for HMDB0038001 (Delphinidin 3-rutinoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra