Jump To Section:

Identification Taxonomy Ontology Physical properties Spectra Biological properties Concentrations Links References XML

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 03:06:00 UTC

Update Date

2022-03-07 02:57:00 UTC

HMDB ID

HMDB0041418

Secondary Accession Numbers

HMDB41418

Metabolite Identification

Common Name

Taxifolin 3-arabinoside

Description

Taxifolin 3-arabinoside belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position. Taxifolin 3-arabinoside has been detected, but not quantified in, fruits and strawberries (Fragaria X ananassa). This could make taxifolin 3-arabinoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Taxifolin 3-arabinoside.

Structure

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

  Mrv0541 10191207242D          

 31 34  0  0  1  0            999 V2000
    0.5798   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5798   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -5.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -5.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -3.6902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -3.6902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0073   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -6.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8476   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -6.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0073   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8476   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7245   -3.6902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5649   -3.6902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7210   -2.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4348   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4348   -2.4557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1520   -3.6937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1520   -2.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8658   -2.4557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8657   -4.1075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0571   -6.6517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3120   -7.4363    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.1370   -7.4363    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3919   -6.6517    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7245   -6.1668    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7245   -5.3418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1765   -6.3967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6219   -8.1038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8271   -8.1038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1627   -8.8574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 27  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 18 19  1  0  0  0  0
 18 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 22 26  1  0  0  0  0
 26 27  1  1  0  0  0
 25 28  1  6  0  0  0
 24 29  1  1  0  0  0
 23 30  1  6  0  0  0
 30 31  1  0  0  0  0
M  END

HMDB0041418
     RDKit          3D
Taxifolin 3-arabinoside
 51 54  0  0  0  0  0  0  0  0999 V2000
    0.8761    2.6419    1.9335 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0739    2.1944    1.1063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6415    3.0986    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3395    4.4485    0.1587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6687    4.9749    0.9524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0128    5.3083   -0.6765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0114    4.7807   -1.4611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7050    5.6202   -2.3098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3282    3.4418   -1.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6555    2.5663   -0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9277    1.2173   -0.4863 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6215    0.5441    0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1345   -0.8170    0.7458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3375   -1.0444    0.0679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9252   -2.2847    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3493   -3.3977    0.6128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9560   -4.6430    0.5358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1662   -3.1854    1.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5142   -4.2293    1.9240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5707   -1.9125    1.3463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1450    0.6899    1.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666    0.1434    0.0837 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6076   -0.7398    0.5189 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8892   -0.2294    0.3264 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3884   -0.8558   -0.8095 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9045   -0.9381   -0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4822    0.3227   -0.7278 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8420   -2.2459   -0.8162 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6139   -2.6132   -2.1434 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5379   -2.0949   -0.0791 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5157   -3.1077    0.8953 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9429    5.9273    0.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7537    6.3741   -0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3998    5.7869   -3.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1180    3.0008   -2.0293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1499    1.1102    1.5579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8264   -0.2019   -0.4271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8597   -2.4658   -0.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5664   -5.4614    0.9647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8460   -5.1608    1.9407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6623   -1.7736    1.8815 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0751    0.2718    2.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5094   -0.8328    1.6391 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1027   -0.3435   -1.7398 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2715   -1.5100    0.0852 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2156   -1.4000   -1.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2178    0.4542   -1.3641 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5263   -2.9686   -0.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1054   -3.4793   -2.1343 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7195   -2.2279   -0.8136 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7708   -2.7538    1.7848 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
  4  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  2  0
 12 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 25 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 21  2  1  0
 30 23  1  0
 10  3  1  0
 20 13  1  0
  5 32  1  0
  6 33  1  0
  8 34  1  0
  9 35  1  0
 12 36  1  0
 14 37  1  0
 15 38  1  0
 17 39  1  0
 19 40  1  0
 20 41  1  0
 21 42  1  0
 23 43  1  1
 25 44  1  6
 26 45  1  0
 26 46  1  0
 27 47  1  0
 28 48  1  1
 29 49  1  0
 30 50  1  6
 31 51  1  0
M  END

  Mrv0541 10191207242D          

 31 34  0  0  1  0            999 V2000
    0.5798   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5798   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -5.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -5.3418    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -3.6902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -3.6902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0073   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2935   -6.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8476   -4.9280    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1374   -6.1659    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0073   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8476   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7245   -3.6902    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5649   -3.6902    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7210   -2.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4348   -4.1039    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4348   -2.4557    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1520   -3.6937    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1520   -2.8661    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8658   -2.4557    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8657   -4.1075    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0571   -6.6517    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3120   -7.4363    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.1370   -7.4363    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    3.3919   -6.6517    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7245   -6.1668    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.7245   -5.3418    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1765   -6.3967    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.6219   -8.1038    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8271   -8.1038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1627   -8.8574    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  1  3  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  2  6  1  0  0  0  0
  3  7  1  0  0  0  0
  3  8  2  0  0  0  0
  4  9  2  0  0  0  0
  4 10  1  0  0  0  0
  5 11  1  0  0  0  0
  6 12  2  0  0  0  0
  7 27  1  0  0  0  0
 11 13  1  0  0  0  0
 12 14  1  0  0  0  0
 13 15  2  0  0  0  0
 13 16  1  0  0  0  0
 15 17  1  0  0  0  0
 16 18  2  0  0  0  0
 17 19  2  0  0  0  0
 19 20  1  0  0  0  0
  7 11  1  0  0  0  0
  9 12  1  0  0  0  0
 18 19  1  0  0  0  0
 18 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 25 26  1  0  0  0  0
 22 26  1  0  0  0  0
 26 27  1  1  0  0  0
 25 28  1  6  0  0  0
 24 29  1  1  0  0  0
 23 30  1  6  0  0  0
 30 31  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0041418

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@@H]1O[C@@H](OC2C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C20H20O11/c21-6-13-15(26)17(28)20(30-13)31-19-16(27)14-11(25)4-8(22)5-12(14)29-18(19)7-1-2-9(23)10(24)3-7/h1-5,13,15,17-26,28H,6H2/t13-,15-,17+,18?,19?,20-/m0/s1

> <INCHI_KEY>
PPDQWYOCNSWEMD-KLDLVKBWSA-N

> <FORMULA>
C20H20O11

> <MOLECULAR_WEIGHT>
436.3662

> <EXACT_MASS>
436.100561482

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
41.337822655759155

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
3-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one

> <ALOGPS_LOGP>
0.45

> <JCHEM_LOGP>
0.6758835643333334

> <ALOGPS_LOGS>
-2.18

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
9.203090316349188

> <JCHEM_PKA_STRONGEST_ACIDIC>
7.796497015281327

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981143629611645

> <JCHEM_POLAR_SURFACE_AREA>
186.37

> <JCHEM_REFRACTIVITY>
101.05969999999999

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
2.89e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0041418
     RDKit          3D
Taxifolin 3-arabinoside
 51 54  0  0  0  0  0  0  0  0999 V2000
    0.8761    2.6419    1.9335 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0739    2.1944    1.1063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6415    3.0986    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3395    4.4485    0.1587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6687    4.9749    0.9524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0128    5.3083   -0.6765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0114    4.7807   -1.4611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7050    5.6202   -2.3098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3282    3.4418   -1.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6555    2.5663   -0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9277    1.2173   -0.4863 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6215    0.5441    0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1345   -0.8170    0.7458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3375   -1.0444    0.0679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9252   -2.2847    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3493   -3.3977    0.6128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9560   -4.6430    0.5358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1662   -3.1854    1.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5142   -4.2293    1.9240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5707   -1.9125    1.3463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1450    0.6899    1.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666    0.1434    0.0837 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6076   -0.7398    0.5189 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8892   -0.2294    0.3264 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3884   -0.8558   -0.8095 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9045   -0.9381   -0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4822    0.3227   -0.7278 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8420   -2.2459   -0.8162 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6139   -2.6132   -2.1434 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5379   -2.0949   -0.0791 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5157   -3.1077    0.8953 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9429    5.9273    0.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7537    6.3741   -0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3998    5.7869   -3.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1180    3.0008   -2.0293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1499    1.1102    1.5579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8264   -0.2019   -0.4271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8597   -2.4658   -0.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5664   -5.4614    0.9647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8460   -5.1608    1.9407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6623   -1.7736    1.8815 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0751    0.2718    2.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5094   -0.8328    1.6391 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1027   -0.3435   -1.7398 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2715   -1.5100    0.0852 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2156   -1.4000   -1.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2178    0.4542   -1.3641 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5263   -2.9686   -0.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1054   -3.4793   -2.1343 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7195   -2.2279   -0.8136 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7708   -2.7538    1.7848 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
  4  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  2  0
 12 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 25 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 21  2  1  0
 30 23  1  0
 10  3  1  0
 20 13  1  0
  5 32  1  0
  6 33  1  0
  8 34  1  0
  9 35  1  0
 12 36  1  0
 14 37  1  0
 15 38  1  0
 17 39  1  0
 19 40  1  0
 20 41  1  0
 21 42  1  0
 23 43  1  1
 25 44  1  6
 26 45  1  0
 26 46  1  0
 27 47  1  0
 28 48  1  1
 29 49  1  0
 30 50  1  6
 31 51  1  0
M  END

HEADER    PROTEIN                                 19-OCT-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   19-OCT-12         0                                  
HETATM    1  C   UNK     0       1.082  -9.199   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       1.082  -7.661   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.415  -9.971   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -0.256  -9.971   0.000  0.00  0.00           C+0
HETATM    5  O   UNK     0       2.415  -6.888   0.000  0.00  0.00           O+0
HETATM    6  C   UNK     0      -0.256  -6.888   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       3.747  -9.199   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0       2.415 -11.510   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -1.582  -9.199   0.000  0.00  0.00           C+0
HETATM   10  O   UNK     0      -0.256 -11.510   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       3.747  -7.661   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.582  -7.661   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       5.086  -6.888   0.000  0.00  0.00           C+0
HETATM   14  O   UNK     0      -2.921  -6.888   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       5.079  -5.350   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       6.412  -7.661   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.412  -4.584   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       7.750  -6.895   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       7.750  -5.350   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       9.083  -4.584   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0       9.083  -7.667   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0       3.840 -12.417   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0       4.316 -13.881   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       5.856 -13.881   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       6.332 -12.417   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       5.086 -11.511   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       5.086  -9.971   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0       7.796 -11.941   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       6.761 -15.127   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       3.411 -15.127   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       4.037 -16.534   0.000  0.00  0.00           O+0
CONECT    1    2    3    4                                                  
CONECT    2    1    5    6                                                  
CONECT    3    1    7    8                                                  
CONECT    4    1    9   10                                                  
CONECT    5    2   11                                                       
CONECT    6    2   12                                                       
CONECT    7    3   27   11                                                  
CONECT    8    3                                                            
CONECT    9    4   12                                                       
CONECT   10    4                                                            
CONECT   11    5   13    7                                                  
CONECT   12    6   14    9                                                  
CONECT   13   11   15   16                                                  
CONECT   14   12                                                            
CONECT   15   13   17                                                       
CONECT   16   13   18                                                       
CONECT   17   15   19                                                       
CONECT   18   16   19   21                                                  
CONECT   19   17   20   18                                                  
CONECT   20   19                                                            
CONECT   21   18                                                            
CONECT   22   23   26                                                       
CONECT   23   22   24   30                                                  
CONECT   24   23   25   29                                                  
CONECT   25   24   26   28                                                  
CONECT   26   25   22   27                                                  
CONECT   27    7   26                                                       
CONECT   28   25                                                            
CONECT   29   24                                                            
CONECT   30   23   31                                                       
CONECT   31   30                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   68    0
END

COMPND    HMDB0041418
HETATM    1  O1  UNL     1       0.876   2.642   1.934  1.00  0.00           O  
HETATM    2  C1  UNL     1       0.074   2.194   1.106  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.642   3.099   0.221  1.00  0.00           C  
HETATM    4  C3  UNL     1      -0.339   4.449   0.159  1.00  0.00           C  
HETATM    5  O2  UNL     1       0.669   4.975   0.952  1.00  0.00           O  
HETATM    6  C4  UNL     1      -1.013   5.308  -0.677  1.00  0.00           C  
HETATM    7  C5  UNL     1      -2.011   4.781  -1.461  1.00  0.00           C  
HETATM    8  O3  UNL     1      -2.705   5.620  -2.310  1.00  0.00           O  
HETATM    9  C6  UNL     1      -2.328   3.442  -1.415  1.00  0.00           C  
HETATM   10  C7  UNL     1      -1.655   2.566  -0.576  1.00  0.00           C  
HETATM   11  O4  UNL     1      -1.928   1.217  -0.486  1.00  0.00           O  
HETATM   12  C8  UNL     1      -1.622   0.544   0.761  1.00  0.00           C  
HETATM   13  C9  UNL     1      -2.134  -0.817   0.746  1.00  0.00           C  
HETATM   14  C10 UNL     1      -3.337  -1.044   0.068  1.00  0.00           C  
HETATM   15  C11 UNL     1      -3.925  -2.285   0.002  1.00  0.00           C  
HETATM   16  C12 UNL     1      -3.349  -3.398   0.613  1.00  0.00           C  
HETATM   17  O5  UNL     1      -3.956  -4.643   0.536  1.00  0.00           O  
HETATM   18  C13 UNL     1      -2.166  -3.185   1.283  1.00  0.00           C  
HETATM   19  O6  UNL     1      -1.514  -4.229   1.924  1.00  0.00           O  
HETATM   20  C14 UNL     1      -1.571  -1.912   1.346  1.00  0.00           C  
HETATM   21  C15 UNL     1      -0.145   0.690   1.036  1.00  0.00           C  
HETATM   22  O7  UNL     1       0.667   0.143   0.084  1.00  0.00           O  
HETATM   23  C16 UNL     1       1.608  -0.740   0.519  1.00  0.00           C  
HETATM   24  O8  UNL     1       2.889  -0.229   0.326  1.00  0.00           O  
HETATM   25  C17 UNL     1       3.388  -0.856  -0.810  1.00  0.00           C  
HETATM   26  C18 UNL     1       4.905  -0.938  -0.788  1.00  0.00           C  
HETATM   27  O9  UNL     1       5.482   0.323  -0.728  1.00  0.00           O  
HETATM   28  C19 UNL     1       2.842  -2.246  -0.816  1.00  0.00           C  
HETATM   29  O10 UNL     1       2.614  -2.613  -2.143  1.00  0.00           O  
HETATM   30  C20 UNL     1       1.538  -2.095  -0.079  1.00  0.00           C  
HETATM   31  O11 UNL     1       1.516  -3.108   0.895  1.00  0.00           O  
HETATM   32  H1  UNL     1       0.943   5.927   0.964  1.00  0.00           H  
HETATM   33  H2  UNL     1      -0.754   6.374  -0.707  1.00  0.00           H  
HETATM   34  H3  UNL     1      -2.400   5.787  -3.261  1.00  0.00           H  
HETATM   35  H4  UNL     1      -3.118   3.001  -2.029  1.00  0.00           H  
HETATM   36  H5  UNL     1      -2.150   1.110   1.558  1.00  0.00           H  
HETATM   37  H6  UNL     1      -3.826  -0.202  -0.427  1.00  0.00           H  
HETATM   38  H7  UNL     1      -4.860  -2.466  -0.524  1.00  0.00           H  
HETATM   39  H8  UNL     1      -3.566  -5.461   0.965  1.00  0.00           H  
HETATM   40  H9  UNL     1      -1.846  -5.161   1.941  1.00  0.00           H  
HETATM   41  H10 UNL     1      -0.662  -1.774   1.882  1.00  0.00           H  
HETATM   42  H11 UNL     1       0.075   0.272   2.022  1.00  0.00           H  
HETATM   43  H12 UNL     1       1.509  -0.833   1.639  1.00  0.00           H  
HETATM   44  H13 UNL     1       3.103  -0.344  -1.740  1.00  0.00           H  
HETATM   45  H14 UNL     1       5.271  -1.510   0.085  1.00  0.00           H  
HETATM   46  H15 UNL     1       5.216  -1.400  -1.745  1.00  0.00           H  
HETATM   47  H16 UNL     1       6.218   0.454  -1.364  1.00  0.00           H  
HETATM   48  H17 UNL     1       3.526  -2.969  -0.317  1.00  0.00           H  
HETATM   49  H18 UNL     1       2.105  -3.479  -2.134  1.00  0.00           H  
HETATM   50  H19 UNL     1       0.720  -2.228  -0.814  1.00  0.00           H  
HETATM   51  H20 UNL     1       1.771  -2.754   1.785  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   21
CONECT    3    4    4   10
CONECT    4    5    6
CONECT    5   32
CONECT    6    7    7   33
CONECT    7    8    9
CONECT    8   34
CONECT    9   10   10   35
CONECT   10   11
CONECT   11   12
CONECT   12   13   21   36
CONECT   13   14   14   20
CONECT   14   15   37
CONECT   15   16   16   38
CONECT   16   17   18
CONECT   17   39
CONECT   18   19   20   20
CONECT   19   40
CONECT   20   41
CONECT   21   22   42
CONECT   22   23
CONECT   23   24   30   43
CONECT   24   25
CONECT   25   26   28   44
CONECT   26   27   45   46
CONECT   27   47
CONECT   28   29   30   48
CONECT   29   49
CONECT   30   31   50
CONECT   31   51
END

HMDB0041418
     RDKit          3D
Taxifolin 3-arabinoside
 51 54  0  0  0  0  0  0  0  0999 V2000
    0.8761    2.6419    1.9335 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0739    2.1944    1.1063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6415    3.0986    0.2213 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3395    4.4485    0.1587 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6687    4.9749    0.9524 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0128    5.3083   -0.6765 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0114    4.7807   -1.4611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7050    5.6202   -2.3098 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3282    3.4418   -1.4148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6555    2.5663   -0.5761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9277    1.2173   -0.4863 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6215    0.5441    0.7610 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1345   -0.8170    0.7458 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3375   -1.0444    0.0679 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9252   -2.2847    0.0016 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3493   -3.3977    0.6128 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9560   -4.6430    0.5358 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1662   -3.1854    1.2827 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5142   -4.2293    1.9240 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5707   -1.9125    1.3463 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1450    0.6899    1.0365 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6666    0.1434    0.0837 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6076   -0.7398    0.5189 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.8892   -0.2294    0.3264 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.3884   -0.8558   -0.8095 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9045   -0.9381   -0.7884 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4822    0.3227   -0.7278 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8420   -2.2459   -0.8162 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6139   -2.6132   -2.1434 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5379   -2.0949   -0.0791 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.5157   -3.1077    0.8953 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9429    5.9273    0.9643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7537    6.3741   -0.7070 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3998    5.7869   -3.2606 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1180    3.0008   -2.0293 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1499    1.1102    1.5579 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8264   -0.2019   -0.4271 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8597   -2.4658   -0.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5664   -5.4614    0.9647 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8460   -5.1608    1.9407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6623   -1.7736    1.8815 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0751    0.2718    2.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5094   -0.8328    1.6391 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1027   -0.3435   -1.7398 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2715   -1.5100    0.0852 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2156   -1.4000   -1.7452 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2178    0.4542   -1.3641 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5263   -2.9686   -0.3172 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1054   -3.4793   -2.1343 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7195   -2.2279   -0.8136 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7708   -2.7538    1.7848 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
  4  6  1  0
  6  7  2  0
  7  8  1  0
  7  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  2  0
 12 21  1  0
 21 22  1  0
 22 23  1  0
 23 24  1  0
 24 25  1  0
 25 26  1  0
 26 27  1  0
 25 28  1  0
 28 29  1  0
 28 30  1  0
 30 31  1  0
 21  2  1  0
 30 23  1  0
 10  3  1  0
 20 13  1  0
  5 32  1  0
  6 33  1  0
  8 34  1  0
  9 35  1  0
 12 36  1  0
 14 37  1  0
 15 38  1  0
 17 39  1  0
 19 40  1  0
 20 41  1  0
 21 42  1  0
 23 43  1  1
 25 44  1  6
 26 45  1  0
 26 46  1  0
 27 47  1  0
 28 48  1  1
 29 49  1  0
 30 50  1  6
 31 51  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₀H₂₀O₁₁

Average Molecular Weight

436.3662

Monoisotopic Molecular Weight

436.100561482

IUPAC Name

3-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-1-benzopyran-4-one

Traditional Name

3-{[(2S,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-2,3-dihydro-1-benzopyran-4-one

CAS Registry Number

Not Available

SMILES

OC[C@@H]1O[C@@H](OC2C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O

InChI Identifier

InChI=1S/C20H20O11/c21-6-13-15(26)17(28)20(30-13)31-19-16(27)14-11(25)4-8(22)5-12(14)29-18(19)7-1-2-9(23)10(24)3-7/h1-5,13,15,17-26,28H,6H2/t13-,15-,17+,18?,19?,20-/m0/s1

InChI Key

PPDQWYOCNSWEMD-KLDLVKBWSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as meta,meta-bridged biphenyls. These are cyclic diarylheptanoids where the two aryl groups are linked to each other by an ether group conjugated to their 3-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Diarylheptanoids

Sub Class

Cyclic diarylheptanoids

Direct Parent

Meta,meta-bridged biphenyls

Alternative Parents

Substituents

Meta,meta-bridged biphenyl
Anisole
1-hydroxy-2-unsubstituted benzenoid
Alkyl aryl ether
Benzenoid
Ketone
Cyclic ketone
Secondary alcohol
Ether
Polyol
Hydrocarbon derivative
Alcohol
Carbonyl group
Organic oxide
Organooxygen compound
Organic oxygen compound
Aromatic homopolycyclic compound

Molecular Framework

Aromatic homopolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0041418)
Cytoplasm (HMDB: HMDB0041418)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0041418)

Source

Exogenous

Exogenous (HMDB: HMDB0041418)

Food

Food (HMDB: HMDB0041418)

Fruit

Berry

Strawberry (FooDB: FOOD00083)

Fruits (FooDB: FOOD00871)

Endogenous

Plant

Plant (HMDB: HMDB0041418)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0041418)

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	2.89 g/L	ALOGPS
logP	0.45	ALOGPS
logP	0.68	ChemAxon
logS	-2.2	ALOGPS
pKa (Strongest Acidic)	7.8	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	11	ChemAxon
Hydrogen Donor Count	7	ChemAxon
Polar Surface Area	186.37 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	101.06 m³·mol⁻¹	ChemAxon
Polarizability	41.34 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]+	200.145	31661259
DarkChem	[M-H]-	194.139	31661259
DeepCCS	[M+H]+	193.705	30932474
DeepCCS	[M-H]-	191.309	30932474
DeepCCS	[M-2H]-	224.412	30932474
DeepCCS	[M+Na]+	199.617	30932474
AllCCS	[M+H]+	200.4	32859911
AllCCS	[M+H-H2O]+	197.9	32859911
AllCCS	[M+NH4]+	202.7	32859911
AllCCS	[M+Na]+	203.4	32859911
AllCCS	[M-H]-	197.1	32859911
AllCCS	[M+Na-2H]-	197.3	32859911
AllCCS	[M+HCOO]-	197.7	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Taxifolin 3-arabinoside	OC[C@@H]1O[C@@H](OC2C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	5024.5	Standard polar	33892256
Taxifolin 3-arabinoside	OC[C@@H]1O[C@@H](OC2C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	3764.3	Standard non polar	33892256
Taxifolin 3-arabinoside	OC[C@@H]1O[C@@H](OC2C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4102.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Taxifolin 3-arabinoside,1TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4015.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O)[C@H]1O)C(C1=CC=C(O)C(O)=C1)O2	4021.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O)=C3)OC2=C1	3994.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #4	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O	3988.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #5	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)=CC=C1O	3980.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)O[C@@H](CO)[C@@H]1O	4063.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TMS,isomer #7	C[Si](C)(C)O[C@H]1[C@H](CO)O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@@H]1O	4033.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	3932.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #10	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O	3912.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #11	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)=CC=C1O	3903.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3896.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3887.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O)=C3)OC2=C1	3887.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #15	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1	3915.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #16	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	3871.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #17	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	3903.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #18	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O[Si](C)(C)C	3845.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #19	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)=CC=C1O	3860.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #2	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	3878.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #20	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)=CC=C1O	3893.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #21	C[Si](C)(C)O[C@H]1[C@H](CO)O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C	3951.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #3	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	3879.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #4	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3865.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #5	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3951.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #6	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3933.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #7	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3896.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #8	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O)C(C1=CC=C(O)C(O)=C1)O2	3946.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	3977.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	3815.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #10	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3773.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #11	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3802.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #12	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3780.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #13	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3786.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #14	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3765.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #15	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3828.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #16	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3812.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #17	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3829.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #18	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3857.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #19	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3847.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #2	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	3821.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #20	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	3866.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #21	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O	3816.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #22	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)=CC=C1O	3804.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #23	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O	3842.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #24	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)=CC=C1O	3830.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #25	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O[Si](C)(C)C	3813.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #26	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3815.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #27	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3804.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3821.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #29	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3793.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #3	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3810.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3811.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1	3809.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #32	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	3790.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #33	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O[Si](C)(C)C	3764.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #34	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O[Si](C)(C)C	3791.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #35	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC=C1O	3784.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #4	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3873.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #5	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3867.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #6	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	3787.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #7	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3777.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #8	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3821.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TMS,isomer #9	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3810.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	3761.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #10	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3782.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #11	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3743.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #12	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3727.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #13	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3721.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #14	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3710.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #15	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3707.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #16	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3726.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #17	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3721.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #18	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3711.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #19	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3689.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #2	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3745.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #20	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3681.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #21	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3750.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #22	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3781.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #23	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3764.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #24	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3790.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #25	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3775.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #26	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3788.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #27	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O	3729.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #28	C[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)=CC=C1O	3724.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #29	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O)C=C1O[Si](C)(C)C	3743.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #3	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3750.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #30	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C)C=C1O[Si](C)(C)C	3760.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3744.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3755.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #33	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3721.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3711.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #35	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O[Si](C)(C)C	3719.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #4	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3743.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #5	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3758.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #6	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3744.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #7	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3727.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #8	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3731.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TMS,isomer #9	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3715.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O	3738.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #10	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3642.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #11	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3713.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #12	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3708.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #13	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3662.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #14	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3651.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #15	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3659.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #16	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C)=C1	3731.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #17	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3721.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #18	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3741.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #19	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3755.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #2	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3729.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #20	C[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]2O[Si](C)(C)C)C=C1O[Si](C)(C)C	3699.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #21	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3702.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #3	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3724.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #4	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3714.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #5	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3712.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #6	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3671.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #7	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3708.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #8	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3696.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,5TMS,isomer #9	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3650.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #1	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O	3689.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #2	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C	3689.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #3	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3654.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #4	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C)C=C3O[Si](C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3645.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #5	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C)OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3647.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #6	C[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C	3643.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,6TMS,isomer #7	C[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)O2)C(O[Si](C)(C)C)=C1	3698.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4274.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O)[C@H]1O)C(C1=CC=C(O)C(O)=C1)O2	4302.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O)=C3)OC2=C1	4252.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O	4264.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)=CC=C1O	4251.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)O[C@@H](CO)[C@@H]1O	4322.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@@H]1O	4292.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4416.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O	4426.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)=CC=C1O	4406.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4393.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4378.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O)=C3)OC2=C1	4383.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1	4404.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4375.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4400.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O[Si](C)(C)C(C)(C)C	4349.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC=C1O	4362.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4364.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC=C1O	4382.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@@H]1O[Si](C)(C)C(C)(C)C	4416.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	4359.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4345.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4406.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4387.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4397.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)C(C1=CC=C(O)C(O)=C1)O2	4433.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	4453.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O	4494.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4466.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4495.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4467.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4480.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4453.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4482.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4512.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4530.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4578.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4561.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	4522.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C)C(C1=CC=C(O)C(O)=C1)O2	4533.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O	4537.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)=CC=C1O	4522.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4557.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)=CC=C1O	4541.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O)C=C1O[Si](C)(C)C(C)(C)C	4521.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4510.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4544.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4558.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4527.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4506.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4540.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O)=C3)OC2=C1	4478.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4474.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O[Si](C)(C)C(C)(C)C	4482.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C	4495.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)=CC=C1O	4457.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4535.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4517.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	4512.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4496.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4479.9	Semi standard non polar	33892256
Taxifolin 3-arabinoside,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4459.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O	4688.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4572.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4624.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4666.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4645.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4643.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4625.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O[Si](C)(C)C(C)(C)C)C=C3OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4526.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4581.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4561.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4554.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4671.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(O)C=C(O)C=C3OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C	4532.7	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4552.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4705.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4687.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4721.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4702.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC2=C(C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)O2)C(O[Si](C)(C)C(C)(C)C)=C1	4681.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O	4607.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)=CC=C1O	4587.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O)C=C1O[Si](C)(C)C(C)(C)C	4624.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4586.8	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C	4636.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4636.3	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4646.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4642.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4619.6	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC=C(C2OC3=CC(O)=CC(O)=C3C(=O)C2O[C@@H]2O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2O[Si](C)(C)C(C)(C)C)C=C1O[Si](C)(C)C(C)(C)C	4542.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O[Si](C)(C)C(C)(C)C)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4563.0	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O	4629.4	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4641.5	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4622.1	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O	4617.2	Semi standard non polar	33892256
Taxifolin 3-arabinoside,4TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@@H](OC2C(=O)C3=C(C=C(O)C=C3O[Si](C)(C)C(C)(C)C)OC2C2=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4600.4	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 - Taxifolin 3-arabinoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-0c03-9001100000-537170fe0ef4e560ad26	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Taxifolin 3-arabinoside GC-MS (3 TMS) - 70eV, Positive	splash10-000i-6900016000-cc117d908fff2b1cedfc	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Taxifolin 3-arabinoside GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Taxifolin 3-arabinoside GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 10V, Positive-QTOF	splash10-0a4r-0338900000-bdebb16d8df39db18c17	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 20V, Positive-QTOF	splash10-0a70-0977200000-c9157b4e00ef6b99cb03	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 40V, Positive-QTOF	splash10-059i-2911000000-453f0683f195cd0cca45	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 10V, Negative-QTOF	splash10-0f79-0114900000-d93597c428613c1932f5	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 20V, Negative-QTOF	splash10-0udr-0957300000-7322d940037366814225	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 40V, Negative-QTOF	splash10-0kc6-2911000000-15d45f6ae408adf5bb37	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 10V, Negative-QTOF	splash10-000i-0000900000-31ae172eff615ff7d6f4	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 20V, Negative-QTOF	splash10-0f79-0900800000-a82a169e8bfed144d434	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 40V, Negative-QTOF	splash10-001i-0591000000-095c83490b9f160ee187	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 10V, Positive-QTOF	splash10-000i-0000900000-001279fe0f4d676c4f20	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 20V, Positive-QTOF	splash10-0uds-0900400000-affa22d92b3b8749d9fe	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Taxifolin 3-arabinoside 40V, Positive-QTOF	splash10-0udi-0920000000-88f96c5ac76d1c41b8bb	2021-09-22	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

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

Not Available

FooDB ID

FDB021363

KNApSAcK ID

Not Available

Chemspider ID

35015178

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

131753138

PDB ID

Not Available

ChEBI ID

Not Available

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 Taxifolin 3-arabinoside (HMDB0041418)

MOL for HMDB0041418 (Taxifolin 3-arabinoside)

3D MOL for HMDB0041418 (Taxifolin 3-arabinoside)

3D SDF for HMDB0041418 (Taxifolin 3-arabinoside)

3D-SDF for HMDB0041418 (Taxifolin 3-arabinoside)

PDB for HMDB0041418 (Taxifolin 3-arabinoside)

3D PDB for HMDB0041418 (Taxifolin 3-arabinoside)

SMILES for HMDB0041418 (Taxifolin 3-arabinoside)

INCHI for HMDB0041418 (Taxifolin 3-arabinoside)

Structure for HMDB0041418 (Taxifolin 3-arabinoside)

3D Structure for HMDB0041418 (Taxifolin 3-arabinoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra