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Showing metabocard for Quercetin 3-arabinoside (HMDB0033795)

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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-11 18:33:29 UTC
Update Date2022-03-07 02:53:51 UTC
HMDB IDHMDB0033795
Secondary Accession Numbers
  • HMDB33795
Metabolite Identification
Common NameQuercetin 3-arabinoside
DescriptionQuercetin 3-arabinoside belongs to the class of organic compounds known as curcuminoids. These are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group. Quercetin 3-arabinoside has been detected, but not quantified in, several different foods, such as apples (Malus pumila), fennels (Foeniculum vulgare), anises (Pimpinella anisum), bilberries (Vaccinium myrtillus), and common walnuts (Juglans regia). This could make quercetin 3-arabinoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Quercetin 3-arabinoside.
Structure
Data?1563862461
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0033795 (Quercetin 3-arabinoside)


  Mrv0541 02241214562D          

 31 34  0  0  0  0            999 V2000
   -1.7862   -1.3107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862   -0.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0725    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0725   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575   -0.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575   -1.3107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2148    1.1643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575    1.1643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    3.2268    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    2.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    1.9893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    1.9893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2148    2.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260   -1.2703    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8411   -1.9377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260   -2.6051    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1107   -2.3502    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1107   -1.5252    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0711   -0.4857    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7781   -1.0403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7781   -2.8351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711   -3.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6231   -4.0029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 11  1  0  0  0  0
 27 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 12 17  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 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
 22 27  1  6  0  0  0
 26 28  1  6  0  0  0
 25 29  1  1  0  0  0
 24 30  1  6  0  0  0
 30 31  1  0  0  0  0
M  END
Download

3D MOL for HMDB0033795 (Quercetin 3-arabinoside)

HMDB0033795
     RDKit          3D
Quercetin 3-arabinoside
 49 52  0  0  0  0  0  0  0  0999 V2000
    0.8229   -0.6112    3.0884 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298   -0.8617    1.9377 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9242   -0.1044    0.8403 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1261    1.0008    0.9319 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2414    1.0591    0.9953 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8869    2.1491    1.4380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2302    1.8114    1.4052 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.1160    2.9389    0.9631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0295    4.0421    1.8136 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4068    0.6535    0.4205 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.4584   -0.5557    1.0789 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0192    0.7507   -0.2834 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1504    1.8784   -1.0814 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4336   -0.4934   -0.3492 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2248    0.2022   -1.6171 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4362   -0.4616   -2.8239 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3256    0.1944   -4.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0027    1.5269   -4.0920 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8877    2.1684   -5.3341 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7936    2.1955   -2.9192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4741    3.5258   -2.9264 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089    1.5156   -1.6877 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2117   -1.5876   -0.4902 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5238   -2.3426    0.5552 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3375   -3.4660    0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6685   -4.2540    1.3960 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4800   -5.3726    1.1607 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1984   -3.9326    2.6703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3948   -2.8105    2.8424 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9115   -2.4631    4.0762 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0453   -1.9988    1.7842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5472    0.1607    1.6484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5096    1.4562    2.4276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1645    2.5825    1.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9054    3.2001   -0.0845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8552    4.6112    1.7582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2156    0.7927   -0.2917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3888   -0.9027    1.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7376   -0.1644   -0.7709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4200    1.6280   -1.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6858   -1.5041   -2.7878 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4983   -0.3522   -4.9540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6445    3.1242   -5.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3774    4.0936   -3.7418 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7435    2.1248   -0.8039 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6536   -3.6297   -0.6912 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7321   -5.9621    1.9261 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4851   -4.5771    3.4830 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1007   -2.9788    4.9282 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
  3 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  2  0
 14 23  1  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  1  0
 26 28  2  0
 28 29  1  0
 29 30  1  0
 29 31  2  0
 31  2  1  0
 12  5  1  0
 22 15  1  0
 31 24  1  0
  5 32  1  1
  7 33  1  1
  8 34  1  0
  8 35  1  0
  9 36  1  0
 10 37  1  6
 11 38  1  0
 12 39  1  6
 13 40  1  0
 16 41  1  0
 17 42  1  0
 19 43  1  0
 21 44  1  0
 22 45  1  0
 25 46  1  0
 27 47  1  0
 28 48  1  0
 30 49  1  0
M  END
Download

3D SDF for HMDB0033795 (Quercetin 3-arabinoside)


  Mrv0541 02241214562D          

 31 34  0  0  0  0            999 V2000
   -1.7862   -1.3107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862   -0.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5012    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7862    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0725    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0725   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575   -0.4857    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575   -1.3107    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2148    1.1643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575   -0.0732    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3575    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3575    1.1643    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    3.2268    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    2.4018    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    1.9893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7861    0.7517    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    1.1643    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5011    1.9893    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2148    2.4018    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260   -1.2703    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.8411   -1.9377    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3260   -2.6051    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.1107   -2.3502    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.1107   -1.5252    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    1.0711   -0.4857    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7781   -1.0403    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7781   -2.8351    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0711   -3.3898    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6231   -4.0029    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
  2  7  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  4 10  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  2  0  0  0  0
  6 13  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  2  0  0  0  0
  8 11  1  0  0  0  0
 27 11  1  0  0  0  0
 11 12  2  0  0  0  0
 12 13  1  0  0  0  0
 12 17  1  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 15 20  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  2  0  0  0  0
 18 19  1  0  0  0  0
 19 20  2  0  0  0  0
 20 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
 22 27  1  6  0  0  0
 26 28  1  6  0  0  0
 25 29  1  1  0  0  0
 24 30  1  6  0  0  0
 30 31  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0033795

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@@H]1O[C@H](OC2=C(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/C20H18O11/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/h1-5,13,15,17,20-26,28H,6H2/t13-,15-,17+,20+/m0/s1

> <INCHI_KEY>
BDCDNTVZSILEOY-BQCJVYABSA-N

> <FORMULA>
C20H18O11

> <MOLECULAR_WEIGHT>
434.3503

> <EXACT_MASS>
434.084911418

> <JCHEM_ACCEPTOR_COUNT>
11

> <JCHEM_AVERAGE_POLARIZABILITY>
41.05915363972958

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
7

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

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

> <ALOGPS_LOGP>
0.76

> <JCHEM_LOGP>
0.4854996460000001

> <ALOGPS_LOGS>
-2.58

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.451143017205652

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.433961808436129

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981152416465515

> <JCHEM_POLAR_SURFACE_AREA>
186.37

> <JCHEM_REFRACTIVITY>
103.31299999999997

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.15e+00 g/l

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

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0033795 (Quercetin 3-arabinoside)

HMDB0033795
     RDKit          3D
Quercetin 3-arabinoside
 49 52  0  0  0  0  0  0  0  0999 V2000
    0.8229   -0.6112    3.0884 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2298   -0.8617    1.9377 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9242   -0.1044    0.8403 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1261    1.0008    0.9319 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2414    1.0591    0.9953 C   0  0  1  0  0  0  0  0  0  0  0  0
   -1.8869    2.1491    1.4380 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2302    1.8114    1.4052 C   0  0  1  0  0  0  0  0  0  0  0  0
   -4.1160    2.9389    0.9631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0295    4.0421    1.8136 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4068    0.6535    0.4205 C   0  0  2  0  0  0  0  0  0  0  0  0
   -3.4584   -0.5557    1.0789 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0192    0.7507   -0.2834 C   0  0  1  0  0  0  0  0  0  0  0  0
   -2.1504    1.8784   -1.0814 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4336   -0.4934   -0.3492 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2248    0.2022   -1.6171 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4362   -0.4616   -2.8239 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3256    0.1944   -4.0252 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0027    1.5269   -4.0920 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8877    2.1684   -5.3341 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7936    2.1955   -2.9192 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4741    3.5258   -2.9264 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9089    1.5156   -1.6877 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2117   -1.5876   -0.4902 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5238   -2.3426    0.5552 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3375   -3.4660    0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6685   -4.2540    1.3960 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4800   -5.3726    1.1607 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1984   -3.9326    2.6703 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3948   -2.8105    2.8424 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9115   -2.4631    4.0762 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0453   -1.9988    1.7842 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5472    0.1607    1.6484 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5096    1.4562    2.4276 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1645    2.5825    1.0030 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9054    3.2001   -0.0845 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8552    4.6112    1.7582 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2156    0.7927   -0.2917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3888   -0.9027    1.1049 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7376   -0.1644   -0.7709 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4200    1.6280   -1.9946 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6858   -1.5041   -2.7878 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4983   -0.3522   -4.9540 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6445    3.1242   -5.4705 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3774    4.0936   -3.7418 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7435    2.1248   -0.8039 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6536   -3.6297   -0.6912 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7321   -5.9621    1.9261 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4851   -4.5771    3.4830 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1007   -2.9788    4.9282 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
  3 14  2  0
 14 15  1  0
 15 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  2  0
 14 23  1  0
 23 24  1  0
 24 25  2  0
 25 26  1  0
 26 27  1  0
 26 28  2  0
 28 29  1  0
 29 30  1  0
 29 31  2  0
 31  2  1  0
 12  5  1  0
 22 15  1  0
 31 24  1  0
  5 32  1  1
  7 33  1  1
  8 34  1  0
  8 35  1  0
  9 36  1  0
 10 37  1  6
 11 38  1  0
 12 39  1  6
 13 40  1  0
 16 41  1  0
 17 42  1  0
 19 43  1  0
 21 44  1  0
 22 45  1  0
 25 46  1  0
 27 47  1  0
 28 48  1  0
 30 49  1  0
M  END
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PDB for HMDB0033795 (Quercetin 3-arabinoside)

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0      -3.334  -2.447   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0      -3.334  -0.907   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      -4.669  -0.137   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -4.669   1.403   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -3.334   2.173   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -2.002   1.403   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -2.002  -0.137   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -0.667  -0.907   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      -0.667  -2.447   0.000  0.00  0.00           O+0
HETATM   10  O   UNK     0      -6.001   2.173   0.000  0.00  0.00           O+0
HETATM   11  C   UNK     0       0.667  -0.137   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.667   1.403   0.000  0.00  0.00           C+0
HETATM   13  O   UNK     0      -0.667   2.173   0.000  0.00  0.00           O+0
HETATM   14  O   UNK     0       3.334   6.023   0.000  0.00  0.00           O+0
HETATM   15  C   UNK     0       3.334   4.483   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.999   3.713   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       1.999   2.173   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       3.334   1.403   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       4.669   2.173   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       4.669   3.713   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       6.001   4.483   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0       2.475  -2.371   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0       1.570  -3.617   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0       2.475  -4.863   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       3.940  -4.387   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       3.940  -2.847   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       1.999  -0.907   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0       5.186  -1.942   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       5.186  -5.292   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0       1.999  -6.328   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0       3.030  -7.472   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3    7                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   10                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7   13                                                  
CONECT    7    2    6    8                                                  
CONECT    8    7    9   11                                                  
CONECT    9    8                                                            
CONECT   10    4                                                            
CONECT   11    8   27   12                                                  
CONECT   12   11   13   17                                                  
CONECT   13    6   12                                                       
CONECT   14   15                                                            
CONECT   15   14   16   20                                                  
CONECT   16   15   17                                                       
CONECT   17   12   16   18                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   15   19   21                                                  
CONECT   21   20                                                            
CONECT   22   23   26   27                                                  
CONECT   23   22   24                                                       
CONECT   24   23   25   30                                                  
CONECT   25   24   26   29                                                  
CONECT   26   25   22   28                                                  
CONECT   27   11   22                                                       
CONECT   28   26                                                            
CONECT   29   25                                                            
CONECT   30   24   31                                                       
CONECT   31   30                                                            
MASTER        0    0    0    0    0    0    0    0   31    0   68    0
END
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3D PDB for HMDB0033795 (Quercetin 3-arabinoside)

COMPND    HMDB0033795
HETATM    1  O1  UNL     1       0.823  -0.611   3.088  1.00  0.00           O  
HETATM    2  C1  UNL     1       1.230  -0.862   1.938  1.00  0.00           C  
HETATM    3  C2  UNL     1       0.924  -0.104   0.840  1.00  0.00           C  
HETATM    4  O2  UNL     1       0.126   1.001   0.932  1.00  0.00           O  
HETATM    5  C3  UNL     1      -1.241   1.059   0.995  1.00  0.00           C  
HETATM    6  O3  UNL     1      -1.887   2.149   1.438  1.00  0.00           O  
HETATM    7  C4  UNL     1      -3.230   1.811   1.405  1.00  0.00           C  
HETATM    8  C5  UNL     1      -4.116   2.939   0.963  1.00  0.00           C  
HETATM    9  O4  UNL     1      -4.029   4.042   1.814  1.00  0.00           O  
HETATM   10  C6  UNL     1      -3.407   0.654   0.420  1.00  0.00           C  
HETATM   11  O5  UNL     1      -3.458  -0.556   1.079  1.00  0.00           O  
HETATM   12  C7  UNL     1      -2.019   0.751  -0.283  1.00  0.00           C  
HETATM   13  O6  UNL     1      -2.150   1.878  -1.081  1.00  0.00           O  
HETATM   14  C8  UNL     1       1.434  -0.493  -0.349  1.00  0.00           C  
HETATM   15  C9  UNL     1       1.225   0.202  -1.617  1.00  0.00           C  
HETATM   16  C10 UNL     1       1.436  -0.462  -2.824  1.00  0.00           C  
HETATM   17  C11 UNL     1       1.326   0.194  -4.025  1.00  0.00           C  
HETATM   18  C12 UNL     1       1.003   1.527  -4.092  1.00  0.00           C  
HETATM   19  O7  UNL     1       0.888   2.168  -5.334  1.00  0.00           O  
HETATM   20  C13 UNL     1       0.794   2.196  -2.919  1.00  0.00           C  
HETATM   21  O8  UNL     1       0.474   3.526  -2.926  1.00  0.00           O  
HETATM   22  C14 UNL     1       0.909   1.516  -1.688  1.00  0.00           C  
HETATM   23  O9  UNL     1       2.212  -1.588  -0.490  1.00  0.00           O  
HETATM   24  C15 UNL     1       2.524  -2.343   0.555  1.00  0.00           C  
HETATM   25  C16 UNL     1       3.338  -3.466   0.332  1.00  0.00           C  
HETATM   26  C17 UNL     1       3.669  -4.254   1.396  1.00  0.00           C  
HETATM   27  O10 UNL     1       4.480  -5.373   1.161  1.00  0.00           O  
HETATM   28  C18 UNL     1       3.198  -3.933   2.670  1.00  0.00           C  
HETATM   29  C19 UNL     1       2.395  -2.811   2.842  1.00  0.00           C  
HETATM   30  O11 UNL     1       1.911  -2.463   4.076  1.00  0.00           O  
HETATM   31  C20 UNL     1       2.045  -1.999   1.784  1.00  0.00           C  
HETATM   32  H1  UNL     1      -1.547   0.161   1.648  1.00  0.00           H  
HETATM   33  H2  UNL     1      -3.510   1.456   2.428  1.00  0.00           H  
HETATM   34  H3  UNL     1      -5.164   2.582   1.003  1.00  0.00           H  
HETATM   35  H4  UNL     1      -3.905   3.200  -0.084  1.00  0.00           H  
HETATM   36  H5  UNL     1      -4.855   4.611   1.758  1.00  0.00           H  
HETATM   37  H6  UNL     1      -4.216   0.793  -0.292  1.00  0.00           H  
HETATM   38  H7  UNL     1      -4.389  -0.903   1.105  1.00  0.00           H  
HETATM   39  H8  UNL     1      -1.738  -0.164  -0.771  1.00  0.00           H  
HETATM   40  H9  UNL     1      -2.420   1.628  -1.995  1.00  0.00           H  
HETATM   41  H10 UNL     1       1.686  -1.504  -2.788  1.00  0.00           H  
HETATM   42  H11 UNL     1       1.498  -0.352  -4.954  1.00  0.00           H  
HETATM   43  H12 UNL     1       0.644   3.124  -5.471  1.00  0.00           H  
HETATM   44  H13 UNL     1       0.377   4.094  -3.742  1.00  0.00           H  
HETATM   45  H14 UNL     1       0.743   2.125  -0.804  1.00  0.00           H  
HETATM   46  H15 UNL     1       3.654  -3.630  -0.691  1.00  0.00           H  
HETATM   47  H16 UNL     1       4.732  -5.962   1.926  1.00  0.00           H  
HETATM   48  H17 UNL     1       3.485  -4.577   3.483  1.00  0.00           H  
HETATM   49  H18 UNL     1       2.101  -2.979   4.928  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   31
CONECT    3    4   14   14
CONECT    4    5
CONECT    5    6   12   32
CONECT    6    7
CONECT    7    8   10   33
CONECT    8    9   34   35
CONECT    9   36
CONECT   10   11   12   37
CONECT   11   38
CONECT   12   13   39
CONECT   13   40
CONECT   14   15   23
CONECT   15   16   16   22
CONECT   16   17   41
CONECT   17   18   18   42
CONECT   18   19   20
CONECT   19   43
CONECT   20   21   22   22
CONECT   21   44
CONECT   22   45
CONECT   23   24
CONECT   24   25   25   31
CONECT   25   26   46
CONECT   26   27   28   28
CONECT   27   47
CONECT   28   29   48
CONECT   29   30   31   31
CONECT   30   49
END
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SMILES for HMDB0033795 (Quercetin 3-arabinoside)

OC[C@@H]1O[C@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O
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INCHI for HMDB0033795 (Quercetin 3-arabinoside)

InChI=1S/C20H18O11/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/h1-5,13,15,17,20-26,28H,6H2/t13-,15-,17+,20+/m0/s1
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View in JSmolView Stereo Labels
Synonyms
ValueSource
GuaiaverinHMDB
GuaijaverinHMDB
GuajavarinHMDB, MeSH
Quercetin 3-L-arabinosideHMDB
Quercetin 3-O-alpha-L-arabinopyranosideHMDB
Quercetin 3-O-alpha-L-arabinosideHMDB, MeSH
Quercetin 3-O-arabinosideHMDB
Chemical FormulaC20H18O11
Average Molecular Weight434.3503
Monoisotopic Molecular Weight434.084911418
IUPAC Name3-{[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4H-chromen-4-one
Traditional Name3-{[(2R,3R,4R,5S)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-2-(3,4-dihydroxyphenyl)-5,7-dihydroxychromen-4-one
CAS Registry Number22255-13-6
SMILES
OC[C@@H]1O[C@H](OC2=C(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/C20H18O11/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/h1-5,13,15,17,20-26,28H,6H2/t13-,15-,17+,20+/m0/s1
InChI KeyBDCDNTVZSILEOY-BQCJVYABSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as curcuminoids. These are aromatic compounds containing a curcumin moiety, which is composed of two aryl buten-2-one (feruloyl) chromophores joined by a methylene group.
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassDiarylheptanoids
Sub ClassLinear diarylheptanoids
Direct ParentCurcuminoids
Alternative Parents
Substituents
  • Desmethoxycurcumin
  • Hydroxycinnamic acid or derivatives
  • Methoxyphenol
  • Anisole
  • Phenoxy compound
  • Phenol ether
  • Styrene
  • Methoxybenzene
  • Phenol
  • 1,3-diketone
  • Alkyl aryl ether
  • 1-hydroxy-2-unsubstituted benzenoid
  • Benzenoid
  • 1,3-dicarbonyl compound
  • Monocyclic benzene moiety
  • Acryloyl-group
  • Alpha,beta-unsaturated ketone
  • Enone
  • Ketone
  • Ether
  • Organooxygen compound
  • Carbonyl group
  • Hydrocarbon derivative
  • Organic oxide
  • Organic oxygen compound
  • Aromatic homomonocyclic compound
Molecular FrameworkAromatic homomonocyclic compounds
External Descriptors
Ontology
Physiological effectNot Available
Disposition
Biological locationRoute of exposureSource
ProcessNot Available
Role
Biological roleIndustrial application
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point239 °CNot Available
Boiling Point828.10 °C. @ 760.00 mm Hg (est)The Good Scents Company Information System
Water Solubility6882 mg/L @ 25 °C (est)The Good Scents Company Information System
LogP1.680 (est)The Good Scents Company Information System
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility1.15 g/LALOGPS
logP0.76ALOGPS
logP0.49ChemAxon
logS-2.6ALOGPS
pKa (Strongest Acidic)6.43ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge-1ChemAxon
Hydrogen Acceptor Count11ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area186.37 ŲChemAxon
Rotatable Bond Count4ChemAxon
Refractivity103.31 m³·mol⁻¹ChemAxon
Polarizability41.06 ųChemAxon
Number of Rings4ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterYesChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DeepCCS[M+H]+193.1430932474
DeepCCS[M-H]-190.74530932474
DeepCCS[M-2H]-223.88530932474
DeepCCS[M+Na]+199.05330932474
AllCCS[M+H]+198.832859911
AllCCS[M+H-H2O]+196.232859911
AllCCS[M+NH4]+201.232859911
AllCCS[M+Na]+201.932859911
AllCCS[M-H]-196.532859911
AllCCS[M+Na-2H]-196.532859911
AllCCS[M+HCOO]-196.732859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
Quercetin 3-arabinosideOC[C@@H]1O[C@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O5999.8Standard polar33892256
Quercetin 3-arabinosideOC[C@@H]1O[C@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O4001.0Standard non polar33892256
Quercetin 3-arabinosideOC[C@@H]1O[C@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@H]1O4170.0Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
Quercetin 3-arabinoside,1TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4104.1Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #2C[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)O24071.5Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #3C[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=C14128.6Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #4C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4072.4Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #5C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4059.5Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #6C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](CO)O[C@@H]1OC1=C(C2=CC=C(O)C(O)=C2)OC2=CC(O)=CC(O)=C2C1=O4155.2Semi standard non polar33892256
Quercetin 3-arabinoside,1TMS,isomer #7C[Si](C)(C)O[C@H]1[C@H](CO)O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O4146.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3996.4Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #10C[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)O24031.3Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #11C[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)O24033.9Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #12C[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=C14043.3Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #13C[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=C14052.8Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #14C[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=C13985.3Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #15C[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=C13974.1Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #16C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4008.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #17C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4017.4Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #18C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3954.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #19C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O3991.2Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3976.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #20C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4001.9Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #21C[Si](C)(C)O[C@H]1[C@H](CO)O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O[Si](C)(C)C4075.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4019.6Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4008.5Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O4051.9Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C4054.6Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #7C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13995.6Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #8C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O3985.5Semi standard non polar33892256
Quercetin 3-arabinoside,2TMS,isomer #9C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O3970.8Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3910.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3928.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3973.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3986.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3971.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3987.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3990.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #16C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13921.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #17C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13931.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #18C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13943.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #19C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13944.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3887.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #20C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O3888.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #21C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O3900.8Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #22C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3874.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #23C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O3875.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #24C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O3891.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #25C[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)O23974.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #26C[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=C13985.6Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #27C[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=C13887.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #28C[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=C13878.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #29C[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=C13904.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3896.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #30C[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=C13896.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #31C[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=C13880.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #32C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O3946.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #33C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3912.6Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #34C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3924.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #35C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O3932.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3947.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3954.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3873.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3880.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3926.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3932.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O3834.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3885.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3864.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3810.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3808.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3804.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3803.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #16C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3871.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #17C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3882.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #18C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3880.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #19C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3934.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3826.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #20C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3919.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #21C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13893.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #22C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13887.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #23C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13884.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #24C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13892.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #25C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13890.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #26C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13895.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #27C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O3823.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #28C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3810.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #29C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3819.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3877.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #30C[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O3812.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #31C[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=C13837.3Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #32C[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=C13829.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #33C[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=C13826.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #34C[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=C13835.9Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #35C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3886.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3878.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3874.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3826.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3825.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3821.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3821.5Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O3856.7Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #10C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3784.5Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #11C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3837.1Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #12C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3851.4Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #13C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3788.0Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #14C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3770.6Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #15C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3834.2Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #16C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13866.3Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #17C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13862.4Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #18C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13863.2Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #19C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13864.3Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3810.9Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #20C[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C3815.9Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #21C[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=C13832.1Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3810.2Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3801.5Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3799.7Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3852.6Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #7C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3843.8Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #8C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3855.6Semi standard non polar33892256
Quercetin 3-arabinoside,5TMS,isomer #9C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3800.4Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #1C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O3836.5Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #2C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C3841.6Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #3C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3809.8Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #4C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3796.6Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #5C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3826.6Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #6C[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C3828.2Semi standard non polar33892256
Quercetin 3-arabinoside,6TMS,isomer #7C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=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=C13860.8Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4380.2Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #2CC(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)O24359.4Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #3CC(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=C14375.5Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4363.4Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4338.7Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](CO)O[C@@H]1OC1=C(C2=CC=C(O)C(O)=C2)OC2=CC(O)=CC(O)=C2C1=O4408.0Semi standard non polar33892256
Quercetin 3-arabinoside,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O4402.2Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4476.8Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #10CC(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)O24501.1Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #11CC(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)O24503.2Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #12CC(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=C14517.7Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #13CC(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=C14523.9Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #14CC(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=C14494.3Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #15CC(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=C14466.2Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4489.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4497.8Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4432.8Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4464.2Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4449.1Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4471.9Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)O[C@H]1[C@H](CO)O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O[Si](C)(C)C(C)(C)C4548.7Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4493.4Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4486.4Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4516.5Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4520.0Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14472.5Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O4483.8Semi standard non polar33892256
Quercetin 3-arabinoside,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O4454.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4564.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4585.6Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4616.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4613.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4600.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4599.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4637.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14601.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14609.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14674.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14635.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4591.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O4601.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O4610.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4560.3Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O4566.8Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O4575.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #25CC(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)O24626.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #26CC(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=C14646.1Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #27CC(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=C14615.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #28CC(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=C14582.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #29CC(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=C14626.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4585.6Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #30CC(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=C14593.2Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #31CC(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=C14570.8Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1=CC=C(C2=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(=O)C3=C(O)C=C(O)C=C3O2)C=C1O4612.6Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4574.7Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4584.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1=CC(C2=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(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O4590.0Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4592.8Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4588.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4556.5Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4549.4Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4565.9Semi standard non polar33892256
Quercetin 3-arabinoside,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4560.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O4685.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4681.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4742.9Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4682.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4681.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4663.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4666.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4655.3Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4678.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4674.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4719.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4671.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C4683.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14678.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14820.2Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14785.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14814.9Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14779.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=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=C14748.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1=CC=C(C2=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(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O4701.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4680.7Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@H]3O[C@@H](CO)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4676.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4675.5Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC1=CC(C2=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(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O4673.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #31CC(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=C14720.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #32CC(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=C14693.8Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #33CC(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=C14700.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #34CC(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=C14699.4Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1=CC=C(C2=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(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C4676.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4664.1Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O4781.9Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4714.6Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4712.3Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O4701.0Semi standard non polar33892256
Quercetin 3-arabinoside,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC[C@@H]1O[C@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C4702.8Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - Quercetin 3-arabinoside GC-MS (Non-derivatized) - 70eV, Positivesplash10-074l-9002200000-2d25b1439162975be1892017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Quercetin 3-arabinoside GC-MS (3 TMS) - 70eV, Positivesplash10-000i-6900016000-052fe746be5b262723302017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - Quercetin 3-arabinoside 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 - Quercetin 3-arabinoside 10V, Positive-QTOFsplash10-0udr-1239700000-28b26f9b0787af6359a82016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 20V, Positive-QTOFsplash10-0udi-0269100000-7a94db25e6a9fec0926f2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 40V, Positive-QTOFsplash10-0f79-3972000000-fc79be30bd59abcaa2682016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 10V, Negative-QTOFsplash10-0f89-1115900000-e00178a2826bcd7052652016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 20V, Negative-QTOFsplash10-0ue9-0649200000-08c4ad36ee9b747c16032016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 40V, Negative-QTOFsplash10-0zgr-2952000000-5bfe8c304eb8f6a070512016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 10V, Negative-QTOFsplash10-001i-0000900000-5783c018f9dec347d81f2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 20V, Negative-QTOFsplash10-0f89-0300900000-54efe938cd8127c33b3b2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 40V, Negative-QTOFsplash10-0ue9-1910200000-7f4dea7cc660d252c92f2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 10V, Positive-QTOFsplash10-000i-0000900000-1453f61e7eeaeb92b36b2021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 20V, Positive-QTOFsplash10-000i-0000900000-a73a1bd1968f25a6dee42021-09-24Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - Quercetin 3-arabinoside 40V, Positive-QTOFsplash10-0udr-1911300000-24dd47b5a2f4224e16022021-09-24Wishart 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 IDNot Available
FooDB IDFDB011955
KNApSAcK IDC00053738
Chemspider ID8427825
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound10252339
PDB IDNot Available
ChEBI ID167916
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDrw1485731
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .