Hmdb loader

Showing metabocard for b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside (HMDB0029281)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 17:29:24 UTC
Update Date2022-03-07 02:52:06 UTC
HMDB IDHMDB0029281
Secondary Accession Numbers
  • HMDB29281
Metabolite Identification
Common Nameb-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside
Descriptionb-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid. Based on a literature review a significant number of articles have been published on b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside.
Structure
Data?1582753397
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)


  Mrv0541 02271201072D          

 33 35  0  0  0  0            999 V2000
    1.4180    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5930    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1805    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5929    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4179    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8305    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8820    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    2.3497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0090   -1.1417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0090   -0.3167    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7235    0.0958    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.4380   -0.3167    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.4380   -1.1417    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.7235   -1.5542    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7235   -2.3792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1524   -1.5542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1524    0.0958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7235    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    0.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9270   -2.7091    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5944   -3.1941    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.3395   -3.9786    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5145   -3.9786    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2596   -3.1941    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4749   -2.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3034   -2.1322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0296   -4.6461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8244   -4.6461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3790   -2.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9921   -3.4912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 22 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 13 22  1  1  0  0  0
 14 15  1  0  0  0  0
 14 21  1  6  0  0  0
 15 16  1  0  0  0  0
 15 20  1  1  0  0  0
 16 17  1  0  0  0  0
 16 19  1  6  0  0  0
 17 18  1  6  0  0  0
 24 18  1  1  0  0  0
 23 24  1  0  0  0  0
 23 27  1  0  0  0  0
 24 25  1  0  0  0  0
 24 32  1  6  0  0  0
 25 26  1  0  0  0  0
 25 31  1  1  0  0  0
 26 27  1  0  0  0  0
 26 30  1  6  0  0  0
 27 28  1  1  0  0  0
 28 29  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
Download

3D MOL for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

HMDB0029281
     RDKit          3D
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside
 61 63  0  0  0  0  0  0  0  0999 V2000
    2.0029    2.4464    0.9532 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6883    1.4057    0.9324 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1484    1.4799    0.8415 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8077    0.3572    0.8241 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2485    0.3363    0.7364 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0085    1.4633    0.6664 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3978    1.3987    0.5828 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0183    0.1808    0.5704 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2718   -0.9728    0.6401 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8955   -0.9007    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0148    0.1851    0.9983 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5850    0.1987    1.0855 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0438   -1.2161    1.1467 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3293   -1.1764    1.2327 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9255   -1.2311    0.0056 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2609   -0.9764   -0.0308 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7185   -0.0394   -0.8956 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4943   -0.3094   -2.3446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0246    0.7510   -3.0783 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1214    0.0101   -0.7185 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5011    1.3118   -0.8209 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.7156    1.5144    0.0903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3648    1.2134    1.4038 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3905    2.1963   -0.3682 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3036    3.3473   -1.1485 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1914    1.3045   -0.5301 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4533    1.2992    0.6524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7727   -2.6873   -0.4699 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.3812   -3.5439    0.4396 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3252   -2.9629   -0.6265 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0303   -3.0741   -2.0053 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5841   -1.9516   -0.0351 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7534   -2.6282    0.3836 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5837    2.4470    0.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2352   -0.5949    0.8786 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5375    2.4409    0.6747 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9754    2.3073    0.5285 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1043    0.1028    0.5056 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7377   -1.9530    0.6321 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2846   -1.7920    0.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2771    0.7851    1.9522 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1768    0.6933    0.1558 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4604   -1.6481    2.1038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3196   -0.6294   -0.6994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4361   -0.4052   -2.6363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0253   -1.2266   -2.6622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3842    1.4982   -3.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8471    1.5461   -1.8533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0995    2.5550   -0.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5399    0.8295   -0.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5428    0.2497    1.5659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5091    2.4531    0.7037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5970    4.1135   -0.5799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5491    1.7502   -1.3205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9224    1.8083    1.3522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3430   -2.7283   -1.4283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8620   -3.4994    1.2802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0909   -3.9845   -0.2123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5925   -2.4204   -2.5121 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9362   -1.2532   -0.8381 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1871   -2.1750    1.1420 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
  2 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 17 16  1  1
 17 18  1  0
 18 19  1  0
 17 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 21 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 15 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 10  5  1  0
 32 13  1  0
 26 17  1  0
  3 34  1  0
  4 35  1  0
  6 36  1  0
  7 37  1  0
  8 38  1  0
  9 39  1  0
 10 40  1  0
 12 41  1  0
 12 42  1  0
 13 43  1  1
 15 44  1  6
 18 45  1  0
 18 46  1  0
 19 47  1  0
 21 48  1  6
 22 49  1  0
 22 50  1  0
 23 51  1  0
 24 52  1  1
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 27 55  1  0
 28 56  1  6
 29 57  1  0
 30 58  1  1
 31 59  1  0
 32 60  1  6
 33 61  1  0
M  END
Download

3D SDF for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)


  Mrv0541 02271201072D          

 33 35  0  0  0  0            999 V2000
    1.4180    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5930    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1805    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5929    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4179    0.2062    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8305    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6445    0.9207    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0570    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8820    1.6352    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    2.3497    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0090   -1.1417    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0090   -0.3167    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7235    0.0958    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.4380   -0.3167    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.4380   -1.1417    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.7235   -1.5542    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.7235   -2.3792    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1524   -1.5542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1524    0.0958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7235    0.9208    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2945    0.0958    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9270   -2.7091    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5944   -3.1941    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.3395   -3.9786    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.5145   -3.9786    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.2596   -3.1941    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -1.4749   -2.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3034   -2.1322    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0296   -4.6461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8244   -4.6461    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3790   -2.9391    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9921   -3.4912    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  6  2  0  0  0  0
  2  3  2  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  3  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  9 10  2  0  0  0  0
  9 11  1  0  0  0  0
 22 11  1  0  0  0  0
 12 13  1  0  0  0  0
 12 17  1  0  0  0  0
 13 14  1  0  0  0  0
 13 22  1  1  0  0  0
 14 15  1  0  0  0  0
 14 21  1  6  0  0  0
 15 16  1  0  0  0  0
 15 20  1  1  0  0  0
 16 17  1  0  0  0  0
 16 19  1  6  0  0  0
 17 18  1  6  0  0  0
 24 18  1  1  0  0  0
 23 24  1  0  0  0  0
 23 27  1  0  0  0  0
 24 25  1  0  0  0  0
 24 32  1  6  0  0  0
 25 26  1  0  0  0  0
 25 31  1  1  0  0  0
 26 27  1  0  0  0  0
 26 30  1  6  0  0  0
 27 28  1  1  0  0  0
 28 29  1  0  0  0  0
 32 33  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0029281

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C21H28O12/c22-8-12-16(26)19(29)21(10-23,32-12)33-20-18(28)17(27)15(25)13(31-20)9-30-14(24)7-6-11-4-2-1-3-5-11/h1-7,12-13,15-20,22-23,25-29H,8-10H2/b7-6+/t12-,13+,15+,16-,17-,18+,19+,20+,21+/m0/s1

> <INCHI_KEY>
ASHAUBLELZYXKD-GASGSQLSSA-N

> <FORMULA>
C21H28O12

> <MOLECULAR_WEIGHT>
472.4398

> <EXACT_MASS>
472.15807636

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
45.47237770839957

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
[(2R,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-phenylprop-2-enoate

> <ALOGPS_LOGP>
-1.24

> <JCHEM_LOGP>
-1.4949442456666664

> <ALOGPS_LOGS>
-1.74

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
12.395584027616426

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.84196414751296

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981433338188096

> <JCHEM_POLAR_SURFACE_AREA>
195.6

> <JCHEM_REFRACTIVITY>
108.34179999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
9

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
8.66e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
[(2R,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-phenylprop-2-enoate

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

HMDB0029281
     RDKit          3D
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside
 61 63  0  0  0  0  0  0  0  0999 V2000
    2.0029    2.4464    0.9532 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6883    1.4057    0.9324 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1484    1.4799    0.8415 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8077    0.3572    0.8241 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2485    0.3363    0.7364 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0085    1.4633    0.6664 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.3978    1.3987    0.5828 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0183    0.1808    0.5704 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.2718   -0.9728    0.6401 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8955   -0.9007    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0148    0.1851    0.9983 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5850    0.1987    1.0855 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0438   -1.2161    1.1467 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.3293   -1.1764    1.2327 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9255   -1.2311    0.0056 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.2609   -0.9764   -0.0308 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7185   -0.0394   -0.8956 C   0  0  1  0  0  0  0  0  0  0  0  0
   -3.4943   -0.3094   -2.3446 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0246    0.7510   -3.0783 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1214    0.0101   -0.7185 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5011    1.3118   -0.8209 C   0  0  1  0  0  0  0  0  0  0  0  0
   -6.7156    1.5144    0.0903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3648    1.2134    1.4038 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3905    2.1963   -0.3682 C   0  0  2  0  0  0  0  0  0  0  0  0
   -4.3036    3.3473   -1.1485 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1914    1.3045   -0.5301 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.4533    1.2992    0.6524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7727   -2.6873   -0.4699 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.3812   -3.5439    0.4396 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3252   -2.9629   -0.6265 C   0  0  1  0  0  0  0  0  0  0  0  0
   -0.0303   -3.0741   -2.0053 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5841   -1.9516   -0.0351 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.7534   -2.6282    0.3836 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5837    2.4470    0.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2352   -0.5949    0.8786 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5375    2.4409    0.6747 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9754    2.3073    0.5285 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1043    0.1028    0.5056 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.7377   -1.9530    0.6321 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2846   -1.7920    0.7787 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2771    0.7851    1.9522 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1768    0.6933    0.1558 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4604   -1.6481    2.1038 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3196   -0.6294   -0.6994 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4361   -0.4052   -2.6363 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0253   -1.2266   -2.6622 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3842    1.4982   -3.1767 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8471    1.5461   -1.8533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0995    2.5550   -0.0031 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.5399    0.8295   -0.1909 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5428    0.2497    1.5659 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5091    2.4531    0.7037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5970    4.1135   -0.5799 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5491    1.7502   -1.3205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9224    1.8083    1.3522 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3430   -2.7283   -1.4283 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8620   -3.4994    1.2802 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0909   -3.9845   -0.2123 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5925   -2.4204   -2.5121 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9362   -1.2532   -0.8381 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1871   -2.1750    1.1420 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
  2 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 17 16  1  1
 17 18  1  0
 18 19  1  0
 17 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  1  0
 21 24  1  0
 24 25  1  0
 24 26  1  0
 26 27  1  0
 15 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 10  5  1  0
 32 13  1  0
 26 17  1  0
  3 34  1  0
  4 35  1  0
  6 36  1  0
  7 37  1  0
  8 38  1  0
  9 39  1  0
 10 40  1  0
 12 41  1  0
 12 42  1  0
 13 43  1  1
 15 44  1  6
 18 45  1  0
 18 46  1  0
 19 47  1  0
 21 48  1  6
 22 49  1  0
 22 50  1  0
 23 51  1  0
 24 52  1  1
 25 53  1  0
 26 54  1  6
 27 55  1  0
 28 56  1  6
 29 57  1  0
 30 58  1  1
 31 59  1  0
 32 60  1  6
 33 61  1  0
M  END
Download

PDB for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

HEADER    PROTEIN                                 27-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-FEB-12         0                                  
HETATM    1  C   UNK     0       2.647   3.052   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.107   3.052   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       0.337   1.719   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.107   0.385   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       2.647   0.385   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       3.417   1.719   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.203   1.719   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -1.973   3.052   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -3.513   3.052   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -4.283   4.386   0.000  0.00  0.00           O+0
HETATM   11  O   UNK     0      -4.283   1.719   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      -5.617  -2.131   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      -5.617  -0.591   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -6.951   0.179   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -8.284  -0.591   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -8.284  -2.131   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -6.951  -2.901   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0      -6.951  -4.441   0.000  0.00  0.00           O+0
HETATM   19  O   UNK     0      -9.618  -2.901   0.000  0.00  0.00           O+0
HETATM   20  O   UNK     0      -9.618   0.179   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0      -6.951   1.719   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0      -4.283   0.179   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -5.464  -5.057   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      -6.710  -5.962   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -6.234  -7.427   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0      -4.694  -7.427   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0      -4.218  -5.962   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -2.753  -5.486   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      -2.433  -3.980   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      -3.789  -8.673   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0      -7.139  -8.673   0.000  0.00  0.00           O+0
HETATM   32  C   UNK     0      -8.174  -5.486   0.000  0.00  0.00           C+0
HETATM   33  O   UNK     0      -9.319  -6.517   0.000  0.00  0.00           O+0
CONECT    1    2    6                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4    7                                                  
CONECT    4    3    5                                                       
CONECT    5    4    6                                                       
CONECT    6    1    5                                                       
CONECT    7    3    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   11                                                  
CONECT   10    9                                                            
CONECT   11    9   22                                                       
CONECT   12   13   17                                                       
CONECT   13   12   14   22                                                  
CONECT   14   13   15   21                                                  
CONECT   15   14   16   20                                                  
CONECT   16   15   17   19                                                  
CONECT   17   12   16   18                                                  
CONECT   18   17   24                                                       
CONECT   19   16                                                            
CONECT   20   15                                                            
CONECT   21   14                                                            
CONECT   22   11   13                                                       
CONECT   23   24   27                                                       
CONECT   24   18   23   25   32                                             
CONECT   25   24   26   31                                                  
CONECT   26   25   27   30                                                  
CONECT   27   23   26   28                                                  
CONECT   28   27   29                                                       
CONECT   29   28                                                            
CONECT   30   26                                                            
CONECT   31   25                                                            
CONECT   32   24   33                                                       
CONECT   33   32                                                            
MASTER        0    0    0    0    0    0    0    0   33    0   70    0
END
Download

3D PDB for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

COMPND    HMDB0029281
HETATM    1  O1  UNL     1       2.003   2.446   0.953  1.00  0.00           O  
HETATM    2  C1  UNL     1       2.688   1.406   0.932  1.00  0.00           C  
HETATM    3  C2  UNL     1       4.148   1.480   0.842  1.00  0.00           C  
HETATM    4  C3  UNL     1       4.808   0.357   0.824  1.00  0.00           C  
HETATM    5  C4  UNL     1       6.249   0.336   0.736  1.00  0.00           C  
HETATM    6  C5  UNL     1       7.009   1.463   0.666  1.00  0.00           C  
HETATM    7  C6  UNL     1       8.398   1.399   0.583  1.00  0.00           C  
HETATM    8  C7  UNL     1       9.018   0.181   0.570  1.00  0.00           C  
HETATM    9  C8  UNL     1       8.272  -0.973   0.640  1.00  0.00           C  
HETATM   10  C9  UNL     1       6.895  -0.901   0.723  1.00  0.00           C  
HETATM   11  O2  UNL     1       2.015   0.185   0.998  1.00  0.00           O  
HETATM   12  C10 UNL     1       0.585   0.199   1.086  1.00  0.00           C  
HETATM   13  C11 UNL     1       0.044  -1.216   1.147  1.00  0.00           C  
HETATM   14  O3  UNL     1      -1.329  -1.176   1.233  1.00  0.00           O  
HETATM   15  C12 UNL     1      -1.925  -1.231   0.006  1.00  0.00           C  
HETATM   16  O4  UNL     1      -3.261  -0.976  -0.031  1.00  0.00           O  
HETATM   17  C13 UNL     1      -3.718  -0.039  -0.896  1.00  0.00           C  
HETATM   18  C14 UNL     1      -3.494  -0.309  -2.345  1.00  0.00           C  
HETATM   19  O5  UNL     1      -4.025   0.751  -3.078  1.00  0.00           O  
HETATM   20  O6  UNL     1      -5.121   0.010  -0.718  1.00  0.00           O  
HETATM   21  C15 UNL     1      -5.501   1.312  -0.821  1.00  0.00           C  
HETATM   22  C16 UNL     1      -6.716   1.514   0.090  1.00  0.00           C  
HETATM   23  O7  UNL     1      -6.365   1.213   1.404  1.00  0.00           O  
HETATM   24  C17 UNL     1      -4.391   2.196  -0.368  1.00  0.00           C  
HETATM   25  O8  UNL     1      -4.304   3.347  -1.149  1.00  0.00           O  
HETATM   26  C18 UNL     1      -3.191   1.305  -0.530  1.00  0.00           C  
HETATM   27  O9  UNL     1      -2.453   1.299   0.652  1.00  0.00           O  
HETATM   28  C19 UNL     1      -1.773  -2.687  -0.470  1.00  0.00           C  
HETATM   29  O10 UNL     1      -2.381  -3.544   0.440  1.00  0.00           O  
HETATM   30  C20 UNL     1      -0.325  -2.963  -0.627  1.00  0.00           C  
HETATM   31  O11 UNL     1      -0.030  -3.074  -2.005  1.00  0.00           O  
HETATM   32  C21 UNL     1       0.584  -1.952  -0.035  1.00  0.00           C  
HETATM   33  O12 UNL     1       1.753  -2.628   0.384  1.00  0.00           O  
HETATM   34  H1  UNL     1       4.584   2.447   0.795  1.00  0.00           H  
HETATM   35  H2  UNL     1       4.235  -0.595   0.879  1.00  0.00           H  
HETATM   36  H3  UNL     1       6.538   2.441   0.675  1.00  0.00           H  
HETATM   37  H4  UNL     1       8.975   2.307   0.528  1.00  0.00           H  
HETATM   38  H5  UNL     1      10.104   0.103   0.506  1.00  0.00           H  
HETATM   39  H6  UNL     1       8.738  -1.953   0.632  1.00  0.00           H  
HETATM   40  H7  UNL     1       6.285  -1.792   0.779  1.00  0.00           H  
HETATM   41  H8  UNL     1       0.277   0.785   1.952  1.00  0.00           H  
HETATM   42  H9  UNL     1       0.177   0.693   0.156  1.00  0.00           H  
HETATM   43  H10 UNL     1       0.460  -1.648   2.104  1.00  0.00           H  
HETATM   44  H11 UNL     1      -1.320  -0.629  -0.699  1.00  0.00           H  
HETATM   45  H12 UNL     1      -2.436  -0.405  -2.636  1.00  0.00           H  
HETATM   46  H13 UNL     1      -4.025  -1.227  -2.662  1.00  0.00           H  
HETATM   47  H14 UNL     1      -3.384   1.498  -3.177  1.00  0.00           H  
HETATM   48  H15 UNL     1      -5.847   1.546  -1.853  1.00  0.00           H  
HETATM   49  H16 UNL     1      -7.099   2.555  -0.003  1.00  0.00           H  
HETATM   50  H17 UNL     1      -7.540   0.830  -0.191  1.00  0.00           H  
HETATM   51  H18 UNL     1      -6.543   0.250   1.566  1.00  0.00           H  
HETATM   52  H19 UNL     1      -4.509   2.453   0.704  1.00  0.00           H  
HETATM   53  H20 UNL     1      -4.597   4.114  -0.580  1.00  0.00           H  
HETATM   54  H21 UNL     1      -2.549   1.750  -1.321  1.00  0.00           H  
HETATM   55  H22 UNL     1      -2.922   1.808   1.352  1.00  0.00           H  
HETATM   56  H23 UNL     1      -2.343  -2.728  -1.428  1.00  0.00           H  
HETATM   57  H24 UNL     1      -1.862  -3.499   1.280  1.00  0.00           H  
HETATM   58  H25 UNL     1      -0.091  -3.984  -0.212  1.00  0.00           H  
HETATM   59  H26 UNL     1      -0.592  -2.420  -2.512  1.00  0.00           H  
HETATM   60  H27 UNL     1       0.936  -1.253  -0.838  1.00  0.00           H  
HETATM   61  H28 UNL     1       2.187  -2.175   1.142  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   11
CONECT    3    4    4   34
CONECT    4    5   35
CONECT    5    6    6   10
CONECT    6    7   36
CONECT    7    8    8   37
CONECT    8    9   38
CONECT    9   10   10   39
CONECT   10   40
CONECT   11   12
CONECT   12   13   41   42
CONECT   13   14   32   43
CONECT   14   15
CONECT   15   16   28   44
CONECT   16   17
CONECT   17   18   20   26
CONECT   18   19   45   46
CONECT   19   47
CONECT   20   21
CONECT   21   22   24   48
CONECT   22   23   49   50
CONECT   23   51
CONECT   24   25   26   52
CONECT   25   53
CONECT   26   27   54
CONECT   27   55
CONECT   28   29   30   56
CONECT   29   57
CONECT   30   31   32   58
CONECT   31   59
CONECT   32   33   60
CONECT   33   61
END
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SMILES for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
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INCHI for HMDB0029281 (b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside)

InChI=1S/C21H28O12/c22-8-12-16(26)19(29)21(10-23,32-12)33-20-18(28)17(27)15(25)13(31-20)9-30-14(24)7-6-11-4-2-1-3-5-11/h1-7,12-13,15-20,22-23,25-29H,8-10H2/b7-6+/t12-,13+,15+,16-,17-,18+,19+,20+,21+/m0/s1
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View in JSmolView NMR AssignmentsView Stereo Labels
Synonyms
ValueSource
b-D-Fructofuranosyl-a-D-(6-O-(e))-feruloylglucopyranosideHMDB
[(2R,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-phenylprop-2-enoic acidHMDB
Chemical FormulaC21H28O12
Average Molecular Weight472.4398
Monoisotopic Molecular Weight472.15807636
IUPAC Name[(2R,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-phenylprop-2-enoate
Traditional Name[(2R,3S,4S,5R,6R)-6-{[(2R,3R,4R,5S)-3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl (2E)-3-phenylprop-2-enoate
CAS Registry NumberNot Available
SMILES
OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
InChI Identifier
InChI=1S/C21H28O12/c22-8-12-16(26)19(29)21(10-23,32-12)33-20-18(28)17(27)15(25)13(31-20)9-30-14(24)7-6-11-4-2-1-3-5-11/h1-7,12-13,15-20,22-23,25-29H,8-10H2/b7-6+/t12-,13+,15+,16-,17-,18+,19+,20+,21+/m0/s1
InChI KeyASHAUBLELZYXKD-GASGSQLSSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as cinnamic acid esters. These are compound containing an ester derivative of cinnamic acid.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassCinnamic acids and derivatives
Sub ClassCinnamic acid esters
Direct ParentCinnamic acid esters
Alternative Parents
Substituents
  • Cinnamic acid ester
  • C-glycosyl compound
  • Disaccharide
  • Glycosyl compound
  • O-glycosyl compound
  • Styrene
  • Ketal
  • Fatty acid ester
  • Monocyclic benzene moiety
  • Fatty acyl
  • Benzenoid
  • Oxane
  • Alpha,beta-unsaturated carboxylic ester
  • Enoate ester
  • Tetrahydrofuran
  • Carboxylic acid ester
  • Secondary alcohol
  • Monocarboxylic acid or derivatives
  • Organoheterocyclic compound
  • Oxacycle
  • Acetal
  • Carboxylic acid derivative
  • Polyol
  • Organooxygen compound
  • Alcohol
  • Hydrocarbon derivative
  • Carbonyl group
  • Organic oxide
  • Organic oxygen compound
  • Primary alcohol
  • Aromatic heteromonocyclic compound
Molecular FrameworkAromatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
Biological locationSource
ProcessNot Available
RoleNot Available
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility8.66 g/LALOGPS
logP-1.2ALOGPS
logP-1.5ChemAxon
logS-1.7ALOGPS
pKa (Strongest Acidic)11.84ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count11ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area195.6 ŲChemAxon
Rotatable Bond Count9ChemAxon
Refractivity108.34 m³·mol⁻¹ChemAxon
Polarizability45.47 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+203.89331661259
DarkChem[M-H]-195.0631661259
DeepCCS[M+H]+198.75130932474
DeepCCS[M-H]-196.39830932474
DeepCCS[M-2H]-229.66230932474
DeepCCS[M+Na]+204.52230932474
AllCCS[M+H]+207.732859911
AllCCS[M+H-H2O]+205.832859911
AllCCS[M+NH4]+209.532859911
AllCCS[M+Na]+210.032859911
AllCCS[M-H]-201.532859911
AllCCS[M+Na-2H]-202.432859911
AllCCS[M+HCOO]-203.532859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucosideOC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O4306.9Standard polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucosideOC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3950.7Standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucosideOC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)\C=C\C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O4020.3Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3746.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #2C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O3760.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #3C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3731.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #4C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O3728.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #5C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O)[C@H]1O3723.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #6C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](CO)O[C@]1(CO)O[C@H]1O[C@H](COC(=O)/C=C/C2=CC=CC=C2)[C@@H](O)[C@H](O)[C@H]1O3763.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TMS,isomer #7C[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O3736.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3702.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #10C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3697.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #11C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3719.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #12C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O3679.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #13C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3700.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #14C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C13661.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #15C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3677.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #16C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)[C@@H]1O3679.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #17C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)[C@@H]1O3697.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #18C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C3669.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #19C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3675.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3685.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #20C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3691.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #21C[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C3679.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O3683.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3681.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3704.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3678.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #7C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O3701.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #8C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O3696.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TMS,isomer #9C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O3688.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3644.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3632.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3656.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3626.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3646.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3620.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3634.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #16C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O3645.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #17C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O3625.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #18C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3639.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #19C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3656.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O3639.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #20C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O3630.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #21C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3640.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #22C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3656.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #23C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3627.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #24C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3652.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #25C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3634.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #26C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3629.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #27C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C13617.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #28C[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@@H]1O3638.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #29C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C13629.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3635.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #30C[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3653.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #31C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C3635.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #32C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@@H]1O3631.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #33C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)[C@@H]1O[Si](C)(C)C3628.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #34C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C3643.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #35C[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C3623.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3643.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3619.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O3642.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3622.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3654.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3626.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O3597.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3601.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3601.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3610.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3581.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3580.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3553.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #16C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3584.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #17C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3592.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #18C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3562.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #19C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3583.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3567.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #20C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3571.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #21C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O3594.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #22C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3589.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #23C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3608.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #24C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3562.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #25C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3580.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #26C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3580.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #27C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3569.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #28C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3592.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #29C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3580.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3597.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #30C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3569.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #31C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C13565.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #32C[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@@H]1O[Si](C)(C)C3594.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #33C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)[C@@H]1O[Si](C)(C)C3593.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #34C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C3614.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #35C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C3579.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3571.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3580.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3595.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3572.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3586.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,4TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3558.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O3563.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3530.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3567.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3546.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3554.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3524.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3536.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #16C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O3549.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #17C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C3576.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #18C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3556.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #19C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3524.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O3573.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #20C[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3538.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #21C[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C3561.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C3543.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3542.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3517.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3541.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O3556.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C3527.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,5TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3543.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3970.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O3964.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O3949.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O3957.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O)[C@H]1O3950.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](CO)O[C@]1(CO)O[C@H]1O[C@H](COC(=O)/C=C/C2=CC=CC=C2)[C@@H](O)[C@H](O)[C@H]1O3974.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O3960.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O4129.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4119.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4122.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O)[C@H]1O4115.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4114.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C14086.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4098.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@@H]1O4128.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O4126.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C(C)(C)C4099.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4121.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O4122.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@@H]1O[C@@]1(CO)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4118.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C(C)(C)C4111.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O)[C@H]1O4131.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4123.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4129.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4124.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O4109.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O4120.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O4110.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O4288.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4280.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4300.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4286.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4293.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4276.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4280.5Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O4266.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O4248.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4271.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4277.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O)[C@H]1O4295.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O4267.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4285.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4290.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4273.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4280.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC[C@]1(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4272.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4266.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C14251.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@@H]1O4267.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)O[C@@H]1COC(=O)/C=C/C1=CC=CC=C14257.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4292.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4274.8Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O)[C@@H]1O[Si](C)(C)C(C)(C)C4253.6Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O4278.1Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@@H]1O[Si](C)(C)C(C)(C)C4267.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](COC(=O)/C=C/C2=CC=CC=C2)O[C@H](O[C@@]2(CO)O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C4276.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C4267.0Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4289.4Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO[Si](C)(C)C(C)(C)C)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4281.3Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)[C@H](O)[C@H]1O4279.2Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O4262.9Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4290.7Semi standard non polar33892256
b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@](CO)(O[C@H]2O[C@H](COC(=O)/C=C/C3=CC=CC=C3)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4273.3Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside GC-MS (Non-derivatized) - 70eV, Positivesplash10-0pi3-9412600000-a03989a8d8a8ca6e497f2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside GC-MS (3 TMS) - 70eV, Positivesplash10-0fl0-9520015000-6df7342b2a29c92e8e592017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 10V, Positive-QTOFsplash10-01q9-0900000000-84810d2851ec0372f2702016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 20V, Positive-QTOFsplash10-03e9-0911000000-9e129a93c65d7d088b952016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 40V, Positive-QTOFsplash10-03du-9600000000-afcece05fe7b5bd867b42016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 10V, Negative-QTOFsplash10-03fr-2900000000-ea41cf1aed4c4d31337c2016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 20V, Negative-QTOFsplash10-01ta-0900000000-a4b6f8f763b70a1c78482016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 40V, Negative-QTOFsplash10-0002-5900000000-0d63ed626b69eb87bc122016-08-04Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 10V, Negative-QTOFsplash10-0ir0-0911600000-2236e00262f175e259e62021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 20V, Negative-QTOFsplash10-03di-3914400000-9decfe89ea2bfe5916902021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 40V, Negative-QTOFsplash10-004i-9500000000-2bf4cb915a3727e90c6b2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 10V, Positive-QTOFsplash10-01wb-0900400000-4b36c715b6a1789bef092021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 20V, Positive-QTOFsplash10-01sj-2900000000-73cd13efc051331463d72021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - b-D-fructosyl-a-D-(6-O-(E))-feruloylglucoside 40V, Positive-QTOFsplash10-0udi-4900000000-8ec1972f3803663a3a192021-09-23Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-25Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound ID529
FooDB IDFDB000280
KNApSAcK IDNot Available
Chemspider ID30776758
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound131750841
PDB IDNot Available
ChEBI ID172700
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. Kujala TS, Loponen JM, Klika KD, Pihlaja K: Phenolics and betacyanins in red beetroot (Beta vulgaris) root: distribution and effect of cold storage on the content of total phenolics and three individual compounds. J Agric Food Chem. 2000 Nov;48(11):5338-42. [PubMed:11087483 ]
  2. Neveu V, Perez-Jimenez J, Vos F, Crespy V, du Chaffaut L, Mennen L, Knox C, Eisner R, Cruz J, Wishart D, Scalbert A: Phenol-Explorer: an online comprehensive database on polyphenol contents in foods. Database (Oxford). 2010;2010:bap024. doi: 10.1093/database/bap024. Epub 2010 Jan 8. [PubMed:20428313 ]