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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2012-09-11 23:16:24 UTC

Update Date

2022-03-07 02:55:35 UTC

HMDB ID

HMDB0037997

Secondary Accession Numbers

HMDB37997

Metabolite Identification

Common Name

Delphinidin 3-glucoside

Description

Delphinidin 3-glucoside, also known as mirtillin, 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. Thus, delphinidin 3-glucoside is considered to be a flavonoid. Delphinidin 3-glucoside exists in all eukaryotes, ranging from yeast to plants to humans. Delphinidin 3-glucoside is found, on average, in the highest concentration within a few different foods, such as bilberries (Vaccinium myrtillus), blackcurrants (Ribes nigrum), and summer grapes (Vitis aestivalis) and in a lower concentration in grape wine, red wine, and red raspberries (Rubus idaeus). Delphinidin 3-glucoside has also been detected, but not quantified in, several different foods, such as yali pears (Pyrus × bretschneideri), ceylon cinnamons (Cinnamomum verum), garland chrysanthemums (Chrysanthemum coronarium), cowpeas (Vigna unguiculata), and red grape. This could make delphinidin 3-glucoside a potential biomarker for the consumption of these foods. Delphinidin 3-glucoside 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 very few articles have been published on Delphinidin 3-glucoside.

Structure

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


  Mrv1652309042000392D          

 33 36  0  0  1  0            999 V2000
    8.0959   -5.3340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8090   -4.0939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5243   -4.5030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5251   -5.3298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2404   -5.7408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9554   -5.3260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9507   -4.4961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2348   -4.0889    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
   11.6626   -4.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3769   -4.4908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0883   -4.0747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0838   -3.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3618   -2.8409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6533   -3.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7950   -2.8310    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3538   -2.0160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6715   -5.7358    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6747   -6.5608    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.9633   -6.9714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9645   -7.7928    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6787   -8.2064    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.3934   -7.7924    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3939   -6.9647    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.1060   -6.5482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1081   -8.2045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6788   -9.0314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2501   -8.2054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5355   -7.7930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8050   -4.4832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8108   -5.7469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8108   -6.5719    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0971   -4.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3826   -4.0941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 12 13  1  0  0  0  0
 32  1  2  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  5  6  2  0  0  0  0
 12 15  1  0  0  0  0
  3  2  2  0  0  0  0
 13 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  2 32  1  0  0  0  0
 18 17  1  1  0  0  0
 18 19  1  0  0  0  0
  7  8  2  0  0  0  0
  8  3  1  0  0  0  0
  7  9  1  0  0  0  0
  1 30  1  0  0  0  0
 18 23  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  9 10  2  0  0  0  0
 23 24  1  6  0  0  0
  3  4  1  0  0  0  0
 22 25  1  1  0  0  0
 10 11  1  0  0  0  0
 21 26  1  6  0  0  0
 30  4  2  0  0  0  0
 20 27  1  1  0  0  0
 11 12  2  0  0  0  0
 27 28  1  0  0  0  0
  4  5  1  0  0  0  0
 11 29  1  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
M  CHG  1   8   1
M  END

HMDB0037997
     RDKit          3D
Delphinidin 3-glucoside
 54 57  0  0  0  0  0  0  0  0999 V2000
    5.4089    1.1115   -2.6297 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0370    0.9048   -2.5176 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6244    0.6297   -1.0888 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2592    0.4396   -1.0869 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7399    0.1831    0.1891 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4974   -0.1887    0.0934 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7518   -0.5626   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0056   -1.8891   -0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2765   -2.3296   -0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5027   -3.6113   -1.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3973   -4.3679   -1.4731 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7772   -4.0580   -1.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8164   -3.2349   -0.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1053   -3.7419   -0.9733 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6084   -1.9655   -0.3526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3135   -1.5029   -0.2397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0767   -0.3148    0.2158 O   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8361    0.1889    0.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7475    1.5500    0.8795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8326    2.0018    1.6710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8899    3.2789    2.1627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9742    3.6767    2.9341 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8804    4.1787    1.9002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8695    5.4770    2.3616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8177    3.7740    1.1366 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    4.5976    0.8238 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7738    2.4657    0.6399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525   -0.9287    0.8898 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4058   -0.3030    1.7850 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3037   -1.6274   -0.2171 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4680   -1.7815   -1.3121 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3760   -0.6149   -0.6536 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1249   -0.3258    0.4825 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8773    0.8582   -1.7931 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7424    0.1008   -3.2199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5555    1.8341   -2.9112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9303    1.4981   -0.4809 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8539    1.1216    0.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1280   -2.4529   -0.7828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5596   -5.2929   -1.8298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9466   -5.0641   -1.6110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8977   -3.1960   -0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4249   -1.3177   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6475    1.3305    1.9028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1024    4.5814    3.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6078    5.8578    2.9274 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2595    5.5526    1.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0342    2.1827   -0.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8477   -1.6120    1.4102 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2138   -0.4902    2.7264 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7684   -2.5769    0.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9515   -1.9039   -2.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0415   -1.0176   -1.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4626   -1.1034    0.9549 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  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 21 23  2  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 25 27  2  0
  5 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32  3  1  0
 18  7  1  0
 27 19  1  0
 16  9  1  0
  1 34  1  0
  2 35  1  0
  2 36  1  0
  3 37  1  1
  5 38  1  1
  8 39  1  0
 11 40  1  0
 12 41  1  0
 14 42  1  0
 15 43  1  0
 20 44  1  0
 22 45  1  0
 24 46  1  0
 26 47  1  0
 27 48  1  0
 28 49  1  1
 29 50  1  0
 30 51  1  1
 31 52  1  0
 32 53  1  6
 33 54  1  0
M  CHG  1  17   1
M  END


  Mrv1652309042000392D          

 33 36  0  0  1  0            999 V2000
    8.0959   -5.3340    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8090   -4.0939    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5243   -4.5030    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5251   -5.3298    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2404   -5.7408    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9554   -5.3260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.9507   -4.4961    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.2348   -4.0889    0.0000 O   0  3  0  0  0  0  0  0  0  0  0  0
   11.6626   -4.0792    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3769   -4.4908    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0883   -4.0747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.0838   -3.2489    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   12.3618   -2.8409    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6533   -3.2595    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   13.7950   -2.8310    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   12.3538   -2.0160    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6715   -5.7358    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6747   -6.5608    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   10.9633   -6.9714    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.9645   -7.7928    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   11.6787   -8.2064    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   12.3934   -7.7924    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   12.3939   -6.9647    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   13.1060   -6.5482    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.1081   -8.2045    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   11.6788   -9.0314    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   10.2501   -8.2054    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.5355   -7.7930    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   13.8050   -4.4832    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.8108   -5.7469    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.8108   -6.5719    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.0971   -4.5066    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3826   -4.0941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 12 13  1  0  0  0  0
 32  1  2  0  0  0  0
 13 14  2  0  0  0  0
 14  9  1  0  0  0  0
  5  6  2  0  0  0  0
 12 15  1  0  0  0  0
  3  2  2  0  0  0  0
 13 16  1  0  0  0  0
  6  7  1  0  0  0  0
  6 17  1  0  0  0  0
  2 32  1  0  0  0  0
 18 17  1  1  0  0  0
 18 19  1  0  0  0  0
  7  8  2  0  0  0  0
  8  3  1  0  0  0  0
  7  9  1  0  0  0  0
  1 30  1  0  0  0  0
 18 23  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 22  1  0  0  0  0
 22 23  1  0  0  0  0
  9 10  2  0  0  0  0
 23 24  1  6  0  0  0
  3  4  1  0  0  0  0
 22 25  1  1  0  0  0
 10 11  1  0  0  0  0
 21 26  1  6  0  0  0
 30  4  2  0  0  0  0
 20 27  1  1  0  0  0
 11 12  2  0  0  0  0
 27 28  1  0  0  0  0
  4  5  1  0  0  0  0
 11 29  1  0  0  0  0
 30 31  1  0  0  0  0
 32 33  1  0  0  0  0
M  CHG  1   8   1
M  END
> <DATABASE_ID>
HMDB0037997

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1/t15-,17-,18+,19-,21-/m1/s1

> <INCHI_KEY>
XENHPQQLDPAYIJ-PEVLUNPASA-O

> <FORMULA>
C21H21O12

> <MOLECULAR_WEIGHT>
465.3842

> <EXACT_MASS>
465.103301136

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
54

> <JCHEM_AVERAGE_POLARIZABILITY>
43.79860266792074

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
9

> <JCHEM_FORMAL_CHARGE>
1

> <JCHEM_GHOSE_FILTER>
1

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

> <ALOGPS_LOGP>
0.93

> <JCHEM_LOGP>
0.10259999999999869

> <ALOGPS_LOGS>
-2.77

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
7.29353247768773

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.366609768744095

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6483954110345156

> <JCHEM_POLAR_SURFACE_AREA>
213.67

> <JCHEM_REFRACTIVITY>
118.23839999999996

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
8.54e-01 g/l

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

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037997
     RDKit          3D
Delphinidin 3-glucoside
 54 57  0  0  0  0  0  0  0  0999 V2000
    5.4089    1.1115   -2.6297 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0370    0.9048   -2.5176 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6244    0.6297   -1.0888 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2592    0.4396   -1.0869 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7399    0.1831    0.1891 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4974   -0.1887    0.0934 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7518   -0.5626   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0056   -1.8891   -0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2765   -2.3296   -0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5027   -3.6113   -1.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3973   -4.3679   -1.4731 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7772   -4.0580   -1.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8164   -3.2349   -0.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1053   -3.7419   -0.9733 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6084   -1.9655   -0.3526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3135   -1.5029   -0.2397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0767   -0.3148    0.2158 O   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8361    0.1889    0.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7475    1.5500    0.8795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8326    2.0018    1.6710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8899    3.2789    2.1627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9742    3.6767    2.9341 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8804    4.1787    1.9002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8695    5.4770    2.3616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8177    3.7740    1.1366 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    4.5976    0.8238 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7738    2.4657    0.6399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525   -0.9287    0.8898 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4058   -0.3030    1.7850 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3037   -1.6274   -0.2171 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4680   -1.7815   -1.3121 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3760   -0.6149   -0.6536 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1249   -0.3258    0.4825 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8773    0.8582   -1.7931 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7424    0.1008   -3.2199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5555    1.8341   -2.9112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9303    1.4981   -0.4809 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8539    1.1216    0.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1280   -2.4529   -0.7828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5596   -5.2929   -1.8298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9466   -5.0641   -1.6110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8977   -3.1960   -0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4249   -1.3177   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6475    1.3305    1.9028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1024    4.5814    3.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6078    5.8578    2.9274 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2595    5.5526    1.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0342    2.1827   -0.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8477   -1.6120    1.4102 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2138   -0.4902    2.7264 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7684   -2.5769    0.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9515   -1.9039   -2.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0415   -1.0176   -1.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4626   -1.1034    0.9549 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  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 21 23  2  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 25 27  2  0
  5 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32  3  1  0
 18  7  1  0
 27 19  1  0
 16  9  1  0
  1 34  1  0
  2 35  1  0
  2 36  1  0
  3 37  1  1
  5 38  1  1
  8 39  1  0
 11 40  1  0
 12 41  1  0
 14 42  1  0
 15 43  1  0
 20 44  1  0
 22 45  1  0
 24 46  1  0
 26 47  1  0
 27 48  1  0
 28 49  1  1
 29 50  1  0
 30 51  1  1
 31 52  1  0
 32 53  1  6
 33 54  1  0
M  CHG  1  17   1
M  END

HEADER    PROTEIN                                 04-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   04-SEP-20         0                                  
HETATM    1  C   UNK     0      15.112  -9.957   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      16.443  -7.642   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      17.779  -8.406   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      17.780  -9.949   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      19.115 -10.716   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      20.450  -9.942   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      20.441  -8.393   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      19.105  -7.633   0.000  0.00  0.00           O+1
HETATM    9  C   UNK     0      21.770  -7.615   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      23.104  -8.383   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      24.431  -7.606   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      24.423  -6.065   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      23.075  -5.303   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      21.753  -6.084   0.000  0.00  0.00           C+0
HETATM   15  O   UNK     0      25.751  -5.285   0.000  0.00  0.00           O+0
HETATM   16  O   UNK     0      23.060  -3.763   0.000  0.00  0.00           O+0
HETATM   17  O   UNK     0      21.787 -10.707   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      21.793 -12.247   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0      20.465 -13.013   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0      20.467 -14.547   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      21.800 -15.319   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      23.134 -14.546   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      23.135 -13.001   0.000  0.00  0.00           C+0
HETATM   24  O   UNK     0      24.465 -12.223   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0      24.468 -15.315   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0      21.800 -16.859   0.000  0.00  0.00           O+0
HETATM   27  C   UNK     0      19.134 -15.317   0.000  0.00  0.00           C+0
HETATM   28  O   UNK     0      17.800 -14.547   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      25.769  -8.369   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      16.447 -10.728   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      16.447 -12.268   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      15.115  -8.412   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      13.781  -7.642   0.000  0.00  0.00           O+0
CONECT    1   32   30                                                       
CONECT    2    3   32                                                       
CONECT    3    2    8    4                                                  
CONECT    4    3   30    5                                                  
CONECT    5    6    4                                                       
CONECT    6    5    7   17                                                  
CONECT    7    6    8    9                                                  
CONECT    8    7    3                                                       
CONECT    9   14    7   10                                                  
CONECT   10    9   11                                                       
CONECT   11   10   12   29                                                  
CONECT   12   13   15   11                                                  
CONECT   13   12   14   16                                                  
CONECT   14   13    9                                                       
CONECT   15   12                                                            
CONECT   16   13                                                            
CONECT   17    6   18                                                       
CONECT   18   17   19   23                                                  
CONECT   19   18   20                                                       
CONECT   20   19   21   27                                                  
CONECT   21   20   22   26                                                  
CONECT   22   21   23   25                                                  
CONECT   23   18   22   24                                                  
CONECT   24   23                                                            
CONECT   25   22                                                            
CONECT   26   21                                                            
CONECT   27   20   28                                                       
CONECT   28   27                                                            
CONECT   29   11                                                            
CONECT   30    1    4   31                                                  
CONECT   31   30                                                            
CONECT   32    1    2   33                                                  
CONECT   33   32                                                            
MASTER        0    0    0    0    0    0    0    0   33    0   72    0
END

COMPND    HMDB0037997
HETATM    1  O1  UNL     1       5.409   1.111  -2.630  1.00  0.00           O  
HETATM    2  C1  UNL     1       4.037   0.905  -2.518  1.00  0.00           C  
HETATM    3  C2  UNL     1       3.624   0.630  -1.089  1.00  0.00           C  
HETATM    4  O2  UNL     1       2.259   0.440  -1.087  1.00  0.00           O  
HETATM    5  C3  UNL     1       1.740   0.183   0.189  1.00  0.00           C  
HETATM    6  O3  UNL     1       0.497  -0.189   0.093  1.00  0.00           O  
HETATM    7  C4  UNL     1      -0.752  -0.563  -0.003  1.00  0.00           C  
HETATM    8  C5  UNL     1      -1.006  -1.889  -0.514  1.00  0.00           C  
HETATM    9  C6  UNL     1      -2.276  -2.330  -0.621  1.00  0.00           C  
HETATM   10  C7  UNL     1      -2.503  -3.611  -1.115  1.00  0.00           C  
HETATM   11  O4  UNL     1      -1.397  -4.368  -1.473  1.00  0.00           O  
HETATM   12  C8  UNL     1      -3.777  -4.058  -1.223  1.00  0.00           C  
HETATM   13  C9  UNL     1      -4.816  -3.235  -0.842  1.00  0.00           C  
HETATM   14  O5  UNL     1      -6.105  -3.742  -0.973  1.00  0.00           O  
HETATM   15  C10 UNL     1      -4.608  -1.965  -0.353  1.00  0.00           C  
HETATM   16  C11 UNL     1      -3.313  -1.503  -0.240  1.00  0.00           C  
HETATM   17  O6  UNL     1      -3.077  -0.315   0.216  1.00  0.00           O1+
HETATM   18  C12 UNL     1      -1.836   0.189   0.347  1.00  0.00           C  
HETATM   19  C13 UNL     1      -1.748   1.550   0.880  1.00  0.00           C  
HETATM   20  C14 UNL     1      -2.833   2.002   1.671  1.00  0.00           C  
HETATM   21  C15 UNL     1      -2.890   3.279   2.163  1.00  0.00           C  
HETATM   22  O7  UNL     1      -3.974   3.677   2.934  1.00  0.00           O  
HETATM   23  C16 UNL     1      -1.880   4.179   1.900  1.00  0.00           C  
HETATM   24  O8  UNL     1      -1.870   5.477   2.362  1.00  0.00           O  
HETATM   25  C17 UNL     1      -0.818   3.774   1.137  1.00  0.00           C  
HETATM   26  O9  UNL     1       0.231   4.598   0.824  1.00  0.00           O  
HETATM   27  C18 UNL     1      -0.774   2.466   0.640  1.00  0.00           C  
HETATM   28  C19 UNL     1       2.553  -0.929   0.890  1.00  0.00           C  
HETATM   29  O10 UNL     1       3.406  -0.303   1.785  1.00  0.00           O  
HETATM   30  C20 UNL     1       3.304  -1.627  -0.217  1.00  0.00           C  
HETATM   31  O11 UNL     1       2.468  -1.782  -1.312  1.00  0.00           O  
HETATM   32  C21 UNL     1       4.376  -0.615  -0.654  1.00  0.00           C  
HETATM   33  O12 UNL     1       5.125  -0.326   0.482  1.00  0.00           O  
HETATM   34  H1  UNL     1       5.877   0.858  -1.793  1.00  0.00           H  
HETATM   35  H2  UNL     1       3.742   0.101  -3.220  1.00  0.00           H  
HETATM   36  H3  UNL     1       3.555   1.834  -2.911  1.00  0.00           H  
HETATM   37  H4  UNL     1       3.930   1.498  -0.481  1.00  0.00           H  
HETATM   38  H5  UNL     1       1.854   1.122   0.821  1.00  0.00           H  
HETATM   39  H6  UNL     1      -0.128  -2.453  -0.783  1.00  0.00           H  
HETATM   40  H7  UNL     1      -1.560  -5.293  -1.830  1.00  0.00           H  
HETATM   41  H8  UNL     1      -3.947  -5.064  -1.611  1.00  0.00           H  
HETATM   42  H9  UNL     1      -6.898  -3.196  -0.715  1.00  0.00           H  
HETATM   43  H10 UNL     1      -5.425  -1.318  -0.053  1.00  0.00           H  
HETATM   44  H11 UNL     1      -3.648   1.331   1.903  1.00  0.00           H  
HETATM   45  H12 UNL     1      -4.102   4.581   3.333  1.00  0.00           H  
HETATM   46  H13 UNL     1      -2.608   5.858   2.927  1.00  0.00           H  
HETATM   47  H14 UNL     1       0.259   5.553   1.152  1.00  0.00           H  
HETATM   48  H15 UNL     1       0.034   2.183  -0.004  1.00  0.00           H  
HETATM   49  H16 UNL     1       1.848  -1.612   1.410  1.00  0.00           H  
HETATM   50  H17 UNL     1       3.214  -0.490   2.726  1.00  0.00           H  
HETATM   51  H18 UNL     1       3.768  -2.577   0.105  1.00  0.00           H  
HETATM   52  H19 UNL     1       2.952  -1.904  -2.166  1.00  0.00           H  
HETATM   53  H20 UNL     1       5.041  -1.018  -1.414  1.00  0.00           H  
HETATM   54  H21 UNL     1       5.463  -1.103   0.955  1.00  0.00           H  
CONECT    1    2   34
CONECT    2    3   35   36
CONECT    3    4   32   37
CONECT    4    5
CONECT    5    6   28   38
CONECT    6    7
CONECT    7    8    8   18
CONECT    8    9   39
CONECT    9   10   10   16
CONECT   10   11   12
CONECT   11   40
CONECT   12   13   13   41
CONECT   13   14   15
CONECT   14   42
CONECT   15   16   16   43
CONECT   16   17
CONECT   17   18   18
CONECT   18   19
CONECT   19   20   20   27
CONECT   20   21   44
CONECT   21   22   23   23
CONECT   22   45
CONECT   23   24   25
CONECT   24   46
CONECT   25   26   27   27
CONECT   26   47
CONECT   27   48
CONECT   28   29   30   49
CONECT   29   50
CONECT   30   31   32   51
CONECT   31   52
CONECT   32   33   53
CONECT   33   54
END

HMDB0037997
     RDKit          3D
Delphinidin 3-glucoside
 54 57  0  0  0  0  0  0  0  0999 V2000
    5.4089    1.1115   -2.6297 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0370    0.9048   -2.5176 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6244    0.6297   -1.0888 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2592    0.4396   -1.0869 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7399    0.1831    0.1891 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.4974   -0.1887    0.0934 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7518   -0.5626   -0.0028 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0056   -1.8891   -0.5144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2765   -2.3296   -0.6215 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5027   -3.6113   -1.1152 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3973   -4.3679   -1.4731 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7772   -4.0580   -1.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8164   -3.2349   -0.8425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1053   -3.7419   -0.9733 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6084   -1.9655   -0.3526 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3135   -1.5029   -0.2397 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0767   -0.3148    0.2158 O   0  0  0  0  0  3  0  0  0  0  0  0
   -1.8361    0.1889    0.3475 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7475    1.5500    0.8795 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8326    2.0018    1.6710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8899    3.2789    2.1627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9742    3.6767    2.9341 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8804    4.1787    1.9002 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8695    5.4770    2.3616 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8177    3.7740    1.1366 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2312    4.5976    0.8238 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7738    2.4657    0.6399 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5525   -0.9287    0.8898 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.4058   -0.3030    1.7850 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3037   -1.6274   -0.2171 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.4680   -1.7815   -1.3121 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3760   -0.6149   -0.6536 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.1249   -0.3258    0.4825 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8773    0.8582   -1.7931 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7424    0.1008   -3.2199 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5555    1.8341   -2.9112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9303    1.4981   -0.4809 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8539    1.1216    0.8213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1280   -2.4529   -0.7828 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5596   -5.2929   -1.8298 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9466   -5.0641   -1.6110 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8977   -3.1960   -0.7154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4249   -1.3177   -0.0529 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6475    1.3305    1.9028 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1024    4.5814    3.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6078    5.8578    2.9274 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2595    5.5526    1.1518 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0342    2.1827   -0.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8477   -1.6120    1.4102 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2138   -0.4902    2.7264 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7684   -2.5769    0.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9515   -1.9039   -2.1662 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0415   -1.0176   -1.4142 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4626   -1.1034    0.9549 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  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 13 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 21 22  1  0
 21 23  2  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 25 27  2  0
  5 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32  3  1  0
 18  7  1  0
 27 19  1  0
 16  9  1  0
  1 34  1  0
  2 35  1  0
  2 36  1  0
  3 37  1  1
  5 38  1  1
  8 39  1  0
 11 40  1  0
 12 41  1  0
 14 42  1  0
 15 43  1  0
 20 44  1  0
 22 45  1  0
 24 46  1  0
 26 47  1  0
 27 48  1  0
 28 49  1  1
 29 50  1  0
 30 51  1  1
 31 52  1  0
 32 53  1  6
 33 54  1  0
M  CHG  1  17   1
M  END

View in JSmol View Stereo Labels

Synonyms

Value	Source
Delfinidin 3-O-beta-D-glucoside	ChEBI
Delphinidin 3-O-glucoside	ChEBI
Mirtillin	Kegg
Delphinidin 3-O-beta-D-glucoside	Kegg
Delfinidin 3-O-b-D-glucoside	Generator
Delfinidin 3-O-β-D-glucoside	Generator
Delphinidin 3-O-b-D-glucoside	Generator
Delphinidin 3-O-β-D-glucoside	Generator
Delphinidin 3-monoglucoside	HMDB
Delphinidin 3-O-beta-D-glucopyranoside	HMDB, MeSH
Delphinidol 3-glucoside	HMDB
Myrtillin	HMDB, MeSH
Myrtillin a	HMDB
Delphinidin 3-O-glucopyranoside	MeSH, HMDB
Delphinidin 3-O-beta-glucoside	MeSH, HMDB
Delphinidin-3-glucoside	MeSH, HMDB

Chemical Formula

C₂₁H₂₁O₁₂

Average Molecular Weight

465.3842

Monoisotopic Molecular Weight

465.103301136

IUPAC Name

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

CAS Registry Number

6906-38-3

SMILES

OC[C@H]1O[C@@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O

InChI Identifier

InChI=1S/C21H20O12/c22-6-15-17(28)18(29)19(30)21(33-15)32-14-5-9-10(24)3-8(23)4-13(9)31-20(14)7-1-11(25)16(27)12(26)2-7/h1-5,15,17-19,21-22,28-30H,6H2,(H4-,23,24,25,26,27)/p+1/t15-,17-,18+,19-,21-/m1/s1

InChI Key

XENHPQQLDPAYIJ-PEVLUNPASA-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

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

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Not Available

Blood (HMDB: HMDB0037997)
Urine (HMDB: HMDB0037997)

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 18789665)

Excreta

Biofluid or Excreta

Urine (PMID: 18789665)

Cellular substructure

Extracellular (HMDB: HMDB0037997)
Cytoplasm (HMDB: HMDB0037997)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0037997)

Source

Exogenous

Food

Food (HMDB: HMDB0037997)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Vegetable

Cabbage

Onion-family vegetable

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Jute (FooDB: FOOD00389)
Lambsquarters (FooDB: FOOD00394)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)

Fruit vegetable

Pepper (FooDB: FOOD00040)
Olive (FooDB: FOOD00121)
Avocado (FooDB: FOOD00130)
Garden tomato (FooDB: FOOD00171)
Cherry tomato (FooDB: FOOD00172)
Garden tomato (var.) (FooDB: FOOD00173)
Eggplant (FooDB: FOOD00174)
Pepper (C. baccatum) (FooDB: FOOD00231)
Pepper (C. chinense) (FooDB: FOOD00232)
Pepper (Capsicum) (FooDB: FOOD00233)
Groundcherry (FooDB: FOOD00371)
Pepper (C. frutescens) (FooDB: FOOD00428)
Mexican groundcherry (FooDB: FOOD00491)
Pepper (C. pubescens) (FooDB: FOOD00849)
Green bell pepper (FooDB: FOOD00877)
Yellow bell pepper (FooDB: FOOD00878)
Orange bell pepper (FooDB: FOOD00879)
Red bell pepper (FooDB: FOOD00880)
Italian sweet red pepper (FooDB: FOOD00881)
Jalapeno pepper (FooDB: FOOD00955)
Cubanelle pepper (FooDB: FOOD00971)

Tuber

Stalk vegetable

Other vegetable

Giant butterbur (FooDB: FOOD00314)
Carob (FooDB: FOOD00321)
Chinese water chestnut (FooDB: FOOD00332)
Horseradish tree (FooDB: FOOD00379)
Sacred lotus (FooDB: FOOD00402)
Nopal (FooDB: FOOD00416)
Okra (FooDB: FOOD00420)
Sesbania flower (FooDB: FOOD00469)
Agave (FooDB: FOOD00563)
Narrowleaf cattail (FooDB: FOOD00564)
Heart of palm (FooDB: FOOD00718)
Tree fern (FooDB: FOOD00797)

Mushroom

Castanospermum australe (FooDB: FOOD00893)
Gentiana lutea (FooDB: FOOD00894)
Juniperus communis (FooDB: FOOD00895)
Albizia gummifera (FooDB: FOOD00896)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Pummelo (FooDB: FOOD00055)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Bilberry (FooDB: FOOD00193)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Cascade huckleberry (FooDB: FOOD00220)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)
Rubus (Blackberry, Raspberry) (FooDB: FOOD00160)

Other fruit

Fig (FooDB: FOOD00081)
Date (FooDB: FOOD00135)
Jujube (FooDB: FOOD00388)

Drupe

Prunus (Cherry, Plum) (FooDB: FOOD00143)
Apricot (FooDB: FOOD00144)
Sweet cherry (FooDB: FOOD00145)
Sour cherry (FooDB: FOOD00146)
European plum (FooDB: FOOD00147)
Peach (FooDB: FOOD00149)
Nectarine (FooDB: FOOD00229)
Peach (var.) (FooDB: FOOD00230)
Common chokecherry (FooDB: FOOD00562)

Berries (HMDB: HMDB0037997)
Fruits (FooDB: FOOD00871)

Nut

Cashew nut (FooDB: FOOD00011)
Peanut (FooDB: FOOD00016)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Pili nut (FooDB: FOOD00432)
Colorado pinyon (FooDB: FOOD00433)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)

Cereal and cereal product

Cereal

Cereal product

Pasta (FooDB: FOOD00273)
Bulgur (FooDB: FOOD00741)
Semolina (FooDB: FOOD00745)
Flour (FooDB: FOOD00799)

Dough

Sourdough (FooDB: FOOD00275)

Leavened bread

Flat bread

Other bread

Potato bread (FooDB: FOOD00811)

Sweet bread

Raisin bread (FooDB: FOOD00817)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

Lupine (FooDB: FOOD00104)
White lupine (FooDB: FOOD00403)

Bean

Green lentil (FooDB: FOOD00970)

Gourd

Watermelon (FooDB: FOOD00052)
Muskmelon (FooDB: FOOD00064)
Cucumber (FooDB: FOOD00065)
Cucurbita (FooDB: FOOD00066)
Bitter gourd (FooDB: FOOD00115)
Winter squash (FooDB: FOOD00283)
Butternut squash (FooDB: FOOD00317)
Calabash (FooDB: FOOD00318)
Chayote (FooDB: FOOD00325)
Towel gourd (FooDB: FOOD00492)
Wax gourd (FooDB: FOOD00499)
Tinda (FooDB: FOOD00559)
Horned melon (FooDB: FOOD00761)
Sunburst squash (pattypan squash) (FooDB: FOOD00874)
Green zucchini (FooDB: FOOD00875)
Yellow zucchini (FooDB: FOOD00876)
Japanese pumpkin (FooDB: FOOD00886)
Acorn squash (FooDB: FOOD00972)
Cantaloupe melon (FooDB: FOOD00984)

Coffee and coffee product

Coffee

Arabica coffee (FooDB: FOOD00059)
Robusta coffee (FooDB: FOOD00060)

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Soy sauce (FooDB: FOOD00694)
Miso (FooDB: FOOD00695)
Tofu (FooDB: FOOD00696)
Soy milk (FooDB: FOOD00736)
Soy cream (FooDB: FOOD00784)

Tea

Herbal tea

Hibiscus tea (FooDB: FOOD00723)
Greenthread tea (FooDB: FOOD00820)

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Dish

Other dish

Taco shell (FooDB: FOOD00991)
Tostada shell (FooDB: FOOD00992)

Beverage

Fermented beverage

Red wine (FooDB: FOOD00911)
Grape wine (FooDB: FOOD00612)

Alcoholic beverage

Red wine (HMDB: HMDB0037997)
Alcoholic beverages (FooDB: FOOD00854)

Endogenous

Plant

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Anthocyanidin Sambubioside Biosynthesis (PathBank: SMP0012030)

Role

Indirect biological role

antioxidant (HMDB: HMDB0037997)

Biological role

Antioxidant (HMDB: HMDB0037997)

Nutrient

Nutrient (HMDB: HMDB0037997)

Industrial application

Manufacturing industry

Material processing agent

Coloring agent

Fluorescent agent

hypoglycemic agent (HMDB: HMDB0037997)

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	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	0.85 g/L	ALOGPS
logP	0.93	ALOGPS
logP	0.1	ChemAxon
logS	-2.8	ALOGPS
pKa (Strongest Acidic)	6.37	ChemAxon
pKa (Strongest Basic)	-3.6	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	9	ChemAxon
Polar Surface Area	213.67 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	118.24 m³·mol⁻¹	ChemAxon
Polarizability	43.8 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	205.218	31661259
DarkChem	[M-H]-	202.288	31661259
DeepCCS	[M+H]+	198.148	30932474
DeepCCS	[M-H]-	195.753	30932474
DeepCCS	[M-2H]-	228.862	30932474
DeepCCS	[M+Na]+	204.125	30932474
AllCCS	[M+H]+	205.6	32859911
AllCCS	[M+H-H2O]+	203.3	32859911
AllCCS	[M+NH4]+	207.8	32859911
AllCCS	[M+Na]+	208.4	32859911
AllCCS	[M-H]-	202.8	32859911
AllCCS	[M+Na-2H]-	203.3	32859911
AllCCS	[M+HCOO]-	203.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Delphinidin 3-glucoside	OC[C@H]1O[C@@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	6960.8	Standard polar	33892256
Delphinidin 3-glucoside	OC[C@H]1O[C@@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4627.6	Standard non polar	33892256
Delphinidin 3-glucoside	OC[C@H]1O[C@@H](OC2=CC3=C(C=C(O)C=C3O)[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4525.2	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Delphinidin 3-glucoside,1TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4407.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4519.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C12	4470.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #4	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4442.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #5	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4390.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@@H](O)[C@@H]1O	4458.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O	4442.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4436.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4318.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4335.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4351.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4323.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	4264.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #14	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4325.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #15	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4271.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #16	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C=C12	4311.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	4331.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	4345.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #19	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4291.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4323.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #20	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4306.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #21	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4323.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #22	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4337.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #23	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4275.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #24	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	4242.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #25	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	4253.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #26	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	4276.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #27	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@@H]1CO	4342.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O	4369.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #29	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	4342.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4295.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4244.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4352.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4344.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4352.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #8	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4329.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4318.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4163.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4187.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4208.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4165.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4132.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4194.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4167.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4191.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4150.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4113.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4146.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4150.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4239.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4270.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4231.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #23	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4163.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #24	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4163.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #25	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4179.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #26	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4101.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #27	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	4085.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4201.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #29	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4196.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4103.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4123.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	4061.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4210.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #33	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4111.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	4048.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4141.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	4076.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #37	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4126.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4100.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #39	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4140.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4212.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #40	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4128.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #41	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4157.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #42	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4146.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #43	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4114.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #44	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)C=C1O	4076.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #45	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	4062.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #46	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	4092.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #47	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C=C12	4192.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #48	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C=C12	4192.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #49	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	4206.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4186.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #50	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4177.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #51	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4174.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #52	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4160.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #53	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4118.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #54	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4189.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #55	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4155.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #56	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4110.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #57	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4178.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #58	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4135.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #59	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4183.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4209.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #60	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	4109.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #61	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	4114.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #62	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	4129.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #63	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O[Si](C)(C)C	4228.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4134.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4089.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4207.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3992.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4044.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3981.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3950.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3987.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4133.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4161.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4133.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4006.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4004.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4049.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3988.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4014.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4054.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3988.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3960.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3998.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #25	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4144.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #26	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4169.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #27	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4146.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #28	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4078.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #29	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4069.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4104.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #30	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4032.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4073.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4053.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #33	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4019.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #34	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4053.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #35	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4109.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #36	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4138.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #37	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4110.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #38	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4047.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #39	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4089.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4073.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #40	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4050.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #41	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4210.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #42	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4088.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #43	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4091.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3993.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #45	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3990.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #46	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4100.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #47	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3965.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #48	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3981.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #49	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3990.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4106.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #50	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3993.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #51	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4031.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #52	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4018.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #53	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4164.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4038.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3979.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4038.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #57	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3981.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #58	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4009.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #59	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4001.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3997.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4043.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3984.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #62	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3974.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3977.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #64	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4007.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #65	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4001.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #66	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4072.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #67	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O	4032.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #68	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4033.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #69	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4002.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3987.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #70	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	3990.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #71	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4037.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #72	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	3974.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #73	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	3971.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #74	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4003.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #75	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3994.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #76	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4052.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #77	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	3968.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #78	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	3971.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #79	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	3975.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4042.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #80	C[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C=C12	4149.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #81	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4128.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #82	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	4059.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #83	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	4043.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #84	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4061.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #85	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4047.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #86	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4089.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #87	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4071.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #88	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4054.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #89	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4064.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4007.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #90	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4095.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,4TMS,isomer #91	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	4063.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3977.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4050.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4042.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4007.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3957.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3932.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3967.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3954.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3931.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3962.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3971.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3966.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3992.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3978.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3938.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3962.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3951.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #25	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4127.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #26	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4029.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #27	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3968.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #28	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3945.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #29	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3982.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3952.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #30	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3970.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3948.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3980.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #33	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3981.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #34	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4004.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #35	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3991.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #36	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3952.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #37	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3977.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #38	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3967.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #39	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4146.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3934.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #40	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4044.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #41	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4009.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #42	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4052.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #43	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4001.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #44	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4020.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #45	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4008.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #46	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3992.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #47	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4019.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #48	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4000.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #49	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4097.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3966.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #50	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4032.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #51	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4051.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #52	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3954.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #53	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3974.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #54	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3948.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #55	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3969.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #56	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3985.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #57	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3972.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #58	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3948.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #59	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3965.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3953.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #60	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3970.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #61	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3964.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #62	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3980.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #63	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3973.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #64	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4026.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #65	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4008.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #66	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3980.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #67	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3969.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #68	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3970.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #69	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3966.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3947.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #70	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3966.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #71	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4025.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #72	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3968.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #73	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3970.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #74	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3999.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #75	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4020.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #76	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O	4000.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #77	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O	3959.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #78	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C	3958.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #79	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3955.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3960.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #80	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3953.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #81	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4010.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #82	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3958.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #83	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3958.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #84	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3987.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #85	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4006.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #86	C[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	3970.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #87	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4030.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #88	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4023.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #89	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4038.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4034.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #90	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4043.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,5TMS,isomer #91	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4046.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	3990.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3959.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3947.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3958.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3959.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4035.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4000.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3973.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4002.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3954.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3963.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3968.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3963.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3950.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3960.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3956.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3993.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #25	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3976.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #26	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4019.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #27	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3988.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #28	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4018.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #29	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3965.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3948.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #30	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3976.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3977.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3967.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #33	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3976.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #34	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3975.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #35	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4007.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #36	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3989.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #37	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4010.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #38	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4018.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #39	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4017.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3970.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #40	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4010.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #41	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4007.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #42	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3961.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #43	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)=[O+]C2=C1	3969.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3977.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #45	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3969.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #46	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3969.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #47	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3960.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #48	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3989.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #49	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3966.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3956.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #50	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3957.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #51	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3979.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #52	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3989.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #53	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3984.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	3980.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4006.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4001.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #57	C[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)=[O+]C2=C1	4002.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #58	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3978.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #59	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3969.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3945.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #60	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3995.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #61	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3991.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #62	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3994.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #63	C[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4035.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3958.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3947.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,6TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C)C=C(O[Si](C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3955.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4683.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4749.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=C12	4727.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4728.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4705.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@@H](O)[C@@H]1O	4707.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O	4695.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4695.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4784.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4811.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4828.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4779.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)=[O+]C2=C1	4751.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O	4776.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)C=C1O	4739.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C=C12	4780.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C=C12	4800.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C=C12	4816.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4783.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4795.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4801.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4820.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4816.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4778.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)C=C1O	4741.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4757.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4775.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@@H]1CO	4835.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O	4854.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4823.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4791.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4749.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4831.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4812.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4815.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4793.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4790.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4844.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4849.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4869.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4833.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4813.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4842.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4806.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4829.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4806.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4769.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4791.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4806.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4879.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4906.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4879.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4864.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4862.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4872.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4846.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)=[O+]C2=C1	4881.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4868.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4876.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4800.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4837.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)=[O+]C2=C1	4827.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C(O)=C3)=[O+]C2=C1	4890.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4835.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)=[O+]C2=C1	4829.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4850.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)=[O+]C2=C1	4838.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4867.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)=[O+]C2=C1	4845.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O	4826.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4869.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4823.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4839.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4852.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4825.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)C=C1O	4810.7	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4813.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4824.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C=C12	4850.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C=C12	4863.2	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=[O+]C(C3=CC(O)=C(O)C(O)=C3)=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C=C12	4877.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4834.5	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O	4824.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4836.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4839.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4819.3	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4854.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4835.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4817.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4855.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4836.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)OC1=CC(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C	4883.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4856.8	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4783.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #61	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4792.9	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #62	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=[O+]C3=CC(O)=CC(O)=C3C=C2O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4812.4	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #63	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=CC3=C(O)C=C(O)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)O[C@H](CO)[C@H]1O[Si](C)(C)C(C)(C)C	4888.0	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4823.1	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4818.6	Semi standard non polar	33892256
Delphinidin 3-glucoside,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=CC3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3[O+]=C2C2=CC(O)=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4877.9	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-glucoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-0feb-9602600000-45aed3fc2911f95c79eb	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (3 TMS) - 70eV, Positive	splash10-014i-5510009000-d60ac3b75f44a32e605b	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_3_54) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_4_71) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_4_81) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_4_87) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_4_88) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_76) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_82) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_83) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_87) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_88) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_5_91) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_6_58) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_6_59) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_6_62) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS (TMS_6_63) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Delphinidin 3-glucoside GC-MS ("Delphinidin 3-glucoside,3TMS,#54" TMS) - 70eV, Positive	Not Available	2021-10-14	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-glucoside LC-ESI-QTOF , negative-QTOF	splash10-0w29-0139400000-820d95dd9b931186bf3c	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-glucoside LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009100000-900e146ee03a33c5e31c	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Delphinidin 3-glucoside 35V, Negative-QTOF	splash10-001i-0091300000-9658b19c1d3c3ad88775	2021-09-20	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 10V, Positive-QTOF	splash10-014i-0100900000-78712e7fc63bf2f6c41c	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 20V, Positive-QTOF	splash10-03dj-1300900000-174d36b448e52a2ab4a1	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 40V, Positive-QTOF	splash10-0002-7902100000-1c91ff38e96e02e42e96	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 10V, Negative-QTOF	splash10-03di-2300900000-0ea3c4becf795cde3fa2	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 20V, Negative-QTOF	splash10-03di-6800900000-cf4c9c44468a09663848	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 40V, Negative-QTOF	splash10-0596-9300000000-05d37d94d7cc9ad734d7	2016-09-12	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 10V, Positive-QTOF	splash10-0aos-0006900000-ff93644803a0dd8e09fa	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 20V, Positive-QTOF	splash10-0a4i-0039400000-bcb4b7e5729a0597c0af	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Delphinidin 3-glucoside 40V, Positive-QTOF	splash10-0k9i-5398200000-c60c5f9ebfd4dff713d0	2021-09-22	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, H₂O, predicted)	2022-08-20	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Blood
Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	18789665	details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	14705874	details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	12592675	details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	21987074	details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	16968056	details
Blood	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	32966057	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	18789665	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	14705874	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	12592675	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	21987074	details
Urine	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 27	16968056	details
Urine	Detected but not Quantified	Not Quantified	Adult (>18 years old)	Both	Normal	32966057	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

Delphinidin-3-O-glucoside

METLIN ID

Not Available

PubChem Compound

13915667

PDB ID

Not Available

ChEBI ID

31463

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

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-glucoside (HMDB0037997)

MOL for HMDB0037997 (Delphinidin 3-glucoside)

3D MOL for HMDB0037997 (Delphinidin 3-glucoside)

3D SDF for HMDB0037997 (Delphinidin 3-glucoside)

3D-SDF for HMDB0037997 (Delphinidin 3-glucoside)

PDB for HMDB0037997 (Delphinidin 3-glucoside)

3D PDB for HMDB0037997 (Delphinidin 3-glucoside)

SMILES for HMDB0037997 (Delphinidin 3-glucoside)

INCHI for HMDB0037997 (Delphinidin 3-glucoside)

Structure for HMDB0037997 (Delphinidin 3-glucoside)

3D Structure for HMDB0037997 (Delphinidin 3-glucoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra