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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 03:19:44 UTC

Update Date

2022-03-07 02:57:06 UTC

HMDB ID

HMDB0041635

Secondary Accession Numbers

HMDB41635

Metabolite Identification

Common Name

Myricetin 3-arabinoside

Description

Myricetin 3-arabinoside belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Myricetin 3-arabinoside has been detected, but not quantified in, american cranberries (Vaccinium macrocarpon). This could make myricetin 3-arabinoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Myricetin 3-arabinoside.

Structure

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

  Mrv0541 02241222502D          

 32 35  0  0  1  0            999 V2000
   -0.9041   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185    0.9791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185   -0.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475   -0.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7620   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7620    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4764    0.9791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896    1.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    2.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    3.0416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393    1.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    2.2166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    0.5666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041   -1.9084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041   -2.7334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896   -3.1459    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5249   -2.7334    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5249   -1.9084    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1896   -1.4959    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1896   -0.6709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2394   -3.1459    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896   -3.9709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 29  1  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  2  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
  4 13  1  0  0  0  0
  2 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 14 22  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
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 23 28  1  0  0  0  0
 28 29  1  1  0  0  0
 27 30  1  6  0  0  0
 26 31  1  1  0  0  0
 25 32  1  1  0  0  0
M  END

HMDB0041635
     RDKit          3D
Myricetin 3-arabinoside
 50 53  0  0  0  0  0  0  0  0999 V2000
    0.5554    2.9189   -0.7778 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3917    2.2118   -0.3451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4173    0.8354   -0.5120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6486    0.2923   -1.1651 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8514   -0.0647   -0.4440 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6840    1.0723   -0.6830 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7897    1.0200    0.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3104   -0.4227    0.2611 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6524   -0.4665    0.5455 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9844   -1.0418   -1.1041 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2215   -0.0697   -2.0629 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4617   -1.2594   -1.0889 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2300   -2.4321   -0.3546 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4553    0.1215   -0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6127   -1.3180   -0.1414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5784   -1.9462    0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8391   -3.3034    0.5742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8241   -3.8334    1.3950 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1315   -4.1085   -0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3642   -5.4737   -0.3809 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1625   -3.5126   -1.0804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4526   -4.3161   -1.9457 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9244   -2.1405   -0.9922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4262    0.7792    0.5937 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    2.0668    0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4808    2.6862    1.4335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4966    4.0493    1.6231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5548    4.6695    2.2938 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4437    4.8280    1.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3899    4.2313    0.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3188    4.9836   -0.0197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4056    2.8665    0.3037 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6726   -0.1405    0.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5969    1.5992   -0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6039    1.4526    1.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6686   -0.9524    0.9929 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9486    0.4188    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5281   -1.9719   -1.2768 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0545    0.4307   -1.9325 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0980   -1.3664   -2.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9436   -3.1299   -1.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1563   -1.3430    1.3321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0845   -4.7878    1.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0490   -5.9705    0.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6182   -5.3006   -2.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1925   -1.7479   -1.6456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2790    2.0437    1.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3305    4.9750    1.7419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    5.8975    1.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2523    5.9701    0.0742 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
  8 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  1  0
 17 19  2  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21 23  2  0
 14 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 29 30  1  0
 30 31  1  0
 30 32  2  0
 32  2  1  0
 12  5  1  0
 23 15  1  0
 32 25  1  0
  5 33  1  1
  7 34  1  0
  7 35  1  0
  8 36  1  1
  9 37  1  0
 10 38  1  6
 11 39  1  0
 12 40  1  6
 13 41  1  0
 16 42  1  0
 18 43  1  0
 20 44  1  0
 22 45  1  0
 23 46  1  0
 26 47  1  0
 28 48  1  0
 29 49  1  0
 31 50  1  0
M  END

  Mrv0541 02241222502D          

 32 35  0  0  1  0            999 V2000
   -0.9041   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185    0.9791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3330   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185   -0.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6185   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475   -0.6709    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7620   -0.2584    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7620    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4764    0.9791    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0475    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896    1.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    2.2166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    3.0416    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393    1.8041    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    2.2166    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393    0.9791    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9538    0.5666    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5249    0.5666    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041   -1.9084    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9041   -2.7334    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896   -3.1459    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5249   -2.7334    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
    0.5249   -1.9084    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1896   -1.4959    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1896   -0.6709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2393   -1.4959    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2394   -3.1459    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1896   -3.9709    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 29  1  1  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  4  5  2  0  0  0  0
  5  6  1  0  0  0  0
  1  6  1  0  0  0  0
  6  7  2  0  0  0  0
  5  8  1  0  0  0  0
  8  9  1  0  0  0  0
  8 10  2  0  0  0  0
 10 11  1  0  0  0  0
 11 12  1  0  0  0  0
 11 13  2  0  0  0  0
  4 13  1  0  0  0  0
  2 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 18  2  0  0  0  0
 18 19  1  0  0  0  0
 18 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 22  2  0  0  0  0
 14 22  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
 26 27  1  0  0  0  0
 27 28  1  0  0  0  0
 23 28  1  0  0  0  0
 28 29  1  1  0  0  0
 27 30  1  6  0  0  0
 26 31  1  1  0  0  0
 25 32  1  1  0  0  0
M  END
> <DATABASE_ID>
HMDB0041635

> <DATABASE_NAME>
hmdb

> <SMILES>
O[C@H]1CO[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2/t11-,15-,17+,20-/m0/s1

> <INCHI_KEY>
SBEOEJNITMVWLK-KJCLSZHRSA-N

> <FORMULA>
C20H18O12

> <MOLECULAR_WEIGHT>
450.3497

> <EXACT_MASS>
450.07982604

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_AVERAGE_POLARIZABILITY>
41.67425553842691

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

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

> <ALOGPS_LOGP>
0.69

> <JCHEM_LOGP>
0.18193432433333304

> <ALOGPS_LOGS>
-2.39

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
8.077437159089559

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.42809370258755

> <JCHEM_PKA_STRONGEST_BASIC>
-3.5265985532894106

> <JCHEM_POLAR_SURFACE_AREA>
206.59999999999997

> <JCHEM_REFRACTIVITY>
105.29389999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
3

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.83e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
5,7-dihydroxy-3-{[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0041635
     RDKit          3D
Myricetin 3-arabinoside
 50 53  0  0  0  0  0  0  0  0999 V2000
    0.5554    2.9189   -0.7778 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3917    2.2118   -0.3451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4173    0.8354   -0.5120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6486    0.2923   -1.1651 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8514   -0.0647   -0.4440 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6840    1.0723   -0.6830 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7897    1.0200    0.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3104   -0.4227    0.2611 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6524   -0.4665    0.5455 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9844   -1.0418   -1.1041 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2215   -0.0697   -2.0629 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4617   -1.2594   -1.0889 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2300   -2.4321   -0.3546 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4553    0.1215   -0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6127   -1.3180   -0.1414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5784   -1.9462    0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8391   -3.3034    0.5742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8241   -3.8334    1.3950 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1315   -4.1085   -0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3642   -5.4737   -0.3809 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1625   -3.5126   -1.0804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4526   -4.3161   -1.9457 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9244   -2.1405   -0.9922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4262    0.7792    0.5937 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    2.0668    0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4808    2.6862    1.4335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4966    4.0493    1.6231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5548    4.6695    2.2938 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4437    4.8280    1.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3899    4.2313    0.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3188    4.9836   -0.0197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4056    2.8665    0.3037 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6726   -0.1405    0.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5969    1.5992   -0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6039    1.4526    1.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6686   -0.9524    0.9929 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9486    0.4188    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5281   -1.9719   -1.2768 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0545    0.4307   -1.9325 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0980   -1.3664   -2.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9436   -3.1299   -1.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1563   -1.3430    1.3321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0845   -4.7878    1.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0490   -5.9705    0.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6182   -5.3006   -2.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1925   -1.7479   -1.6456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2790    2.0437    1.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3305    4.9750    1.7419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    5.8975    1.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2523    5.9701    0.0742 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
  8 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  1  0
 17 19  2  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21 23  2  0
 14 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 29 30  1  0
 30 31  1  0
 30 32  2  0
 32  2  1  0
 12  5  1  0
 23 15  1  0
 32 25  1  0
  5 33  1  1
  7 34  1  0
  7 35  1  0
  8 36  1  1
  9 37  1  0
 10 38  1  6
 11 39  1  0
 12 40  1  6
 13 41  1  0
 16 42  1  0
 18 43  1  0
 20 44  1  0
 22 45  1  0
 23 46  1  0
 26 47  1  0
 28 48  1  0
 29 49  1  0
 31 50  1  0
M  END

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  C   UNK     0      -1.688  -0.482   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -1.688   1.058   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      -3.021   1.828   0.000  0.00  0.00           O+0
HETATM    4  C   UNK     0      -4.355   1.058   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      -4.355  -0.482   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -3.021  -1.252   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      -3.021  -2.792   0.000  0.00  0.00           O+0
HETATM    8  C   UNK     0      -5.689  -1.252   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      -5.689  -2.792   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      -7.022  -0.482   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -7.022   1.058   0.000  0.00  0.00           C+0
HETATM   12  O   UNK     0      -8.356   1.828   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      -5.689   1.828   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -0.354   1.828   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -0.354   3.368   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       0.980   4.138   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       0.980   5.678   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0       2.313   3.368   0.000  0.00  0.00           C+0
HETATM   19  O   UNK     0       3.647   4.138   0.000  0.00  0.00           O+0
HETATM   20  C   UNK     0       2.313   1.828   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0       3.647   1.058   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0       0.980   1.058   0.000  0.00  0.00           C+0
HETATM   23  O   UNK     0      -1.688  -3.562   0.000  0.00  0.00           O+0
HETATM   24  C   UNK     0      -1.688  -5.102   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -0.354  -5.872   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       0.980  -5.102   0.000  0.00  0.00           C+0
HETATM   27  C   UNK     0       0.980  -3.562   0.000  0.00  0.00           C+0
HETATM   28  C   UNK     0      -0.354  -2.792   0.000  0.00  0.00           C+0
HETATM   29  O   UNK     0      -0.354  -1.252   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       2.313  -2.792   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       2.314  -5.872   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      -0.354  -7.412   0.000  0.00  0.00           O+0
CONECT    1   29    2    6                                                  
CONECT    2    1    3   14                                                  
CONECT    3    2    4                                                       
CONECT    4    3    5   13                                                  
CONECT    5    4    6    8                                                  
CONECT    6    5    1    7                                                  
CONECT    7    6                                                            
CONECT    8    5    9   10                                                  
CONECT    9    8                                                            
CONECT   10    8   11                                                       
CONECT   11   10   12   13                                                  
CONECT   12   11                                                            
CONECT   13   11    4                                                       
CONECT   14    2   15   22                                                  
CONECT   15   14   16                                                       
CONECT   16   15   17   18                                                  
CONECT   17   16                                                            
CONECT   18   16   19   20                                                  
CONECT   19   18                                                            
CONECT   20   18   21   22                                                  
CONECT   21   20                                                            
CONECT   22   20   14                                                       
CONECT   23   24   28                                                       
CONECT   24   23   25                                                       
CONECT   25   24   26   32                                                  
CONECT   26   25   27   31                                                  
CONECT   27   26   28   30                                                  
CONECT   28   27   23   29                                                  
CONECT   29    1   28                                                       
CONECT   30   27                                                            
CONECT   31   26                                                            
CONECT   32   25                                                            
MASTER        0    0    0    0    0    0    0    0   32    0   70    0
END

COMPND    HMDB0041635
HETATM    1  O1  UNL     1       0.555   2.919  -0.778  1.00  0.00           O  
HETATM    2  C1  UNL     1      -0.392   2.212  -0.345  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.417   0.835  -0.512  1.00  0.00           C  
HETATM    4  O2  UNL     1       0.649   0.292  -1.165  1.00  0.00           O  
HETATM    5  C3  UNL     1       1.851  -0.065  -0.444  1.00  0.00           C  
HETATM    6  O3  UNL     1       2.684   1.072  -0.683  1.00  0.00           O  
HETATM    7  C4  UNL     1       3.790   1.020   0.172  1.00  0.00           C  
HETATM    8  C5  UNL     1       4.310  -0.423   0.261  1.00  0.00           C  
HETATM    9  O4  UNL     1       5.652  -0.466   0.546  1.00  0.00           O  
HETATM   10  C6  UNL     1       3.984  -1.042  -1.104  1.00  0.00           C  
HETATM   11  O5  UNL     1       4.221  -0.070  -2.063  1.00  0.00           O  
HETATM   12  C7  UNL     1       2.462  -1.259  -1.089  1.00  0.00           C  
HETATM   13  O6  UNL     1       2.230  -2.432  -0.355  1.00  0.00           O  
HETATM   14  C8  UNL     1      -1.455   0.121  -0.034  1.00  0.00           C  
HETATM   15  C9  UNL     1      -1.613  -1.318  -0.141  1.00  0.00           C  
HETATM   16  C10 UNL     1      -2.578  -1.946   0.638  1.00  0.00           C  
HETATM   17  C11 UNL     1      -2.839  -3.303   0.574  1.00  0.00           C  
HETATM   18  O7  UNL     1      -3.824  -3.833   1.395  1.00  0.00           O  
HETATM   19  C12 UNL     1      -2.132  -4.108  -0.289  1.00  0.00           C  
HETATM   20  O8  UNL     1      -2.364  -5.474  -0.381  1.00  0.00           O  
HETATM   21  C13 UNL     1      -1.162  -3.513  -1.080  1.00  0.00           C  
HETATM   22  O9  UNL     1      -0.453  -4.316  -1.946  1.00  0.00           O  
HETATM   23  C14 UNL     1      -0.924  -2.140  -0.992  1.00  0.00           C  
HETATM   24  O10 UNL     1      -2.426   0.779   0.594  1.00  0.00           O  
HETATM   25  C15 UNL     1      -2.436   2.067   0.770  1.00  0.00           C  
HETATM   26  C16 UNL     1      -3.481   2.686   1.433  1.00  0.00           C  
HETATM   27  C17 UNL     1      -3.497   4.049   1.623  1.00  0.00           C  
HETATM   28  O11 UNL     1      -4.555   4.669   2.294  1.00  0.00           O  
HETATM   29  C18 UNL     1      -2.444   4.828   1.141  1.00  0.00           C  
HETATM   30  C19 UNL     1      -1.390   4.231   0.476  1.00  0.00           C  
HETATM   31  O12 UNL     1      -0.319   4.984  -0.020  1.00  0.00           O  
HETATM   32  C20 UNL     1      -1.406   2.867   0.304  1.00  0.00           C  
HETATM   33  H1  UNL     1       1.673  -0.140   0.640  1.00  0.00           H  
HETATM   34  H2  UNL     1       4.597   1.599  -0.323  1.00  0.00           H  
HETATM   35  H3  UNL     1       3.604   1.453   1.155  1.00  0.00           H  
HETATM   36  H4  UNL     1       3.669  -0.952   0.993  1.00  0.00           H  
HETATM   37  H5  UNL     1       5.949   0.419   0.838  1.00  0.00           H  
HETATM   38  H6  UNL     1       4.528  -1.972  -1.277  1.00  0.00           H  
HETATM   39  H7  UNL     1       5.054   0.431  -1.933  1.00  0.00           H  
HETATM   40  H8  UNL     1       2.098  -1.366  -2.150  1.00  0.00           H  
HETATM   41  H9  UNL     1       1.944  -3.130  -1.013  1.00  0.00           H  
HETATM   42  H10 UNL     1      -3.156  -1.343   1.332  1.00  0.00           H  
HETATM   43  H11 UNL     1      -4.085  -4.788   1.424  1.00  0.00           H  
HETATM   44  H12 UNL     1      -3.049  -5.971   0.161  1.00  0.00           H  
HETATM   45  H13 UNL     1      -0.618  -5.301  -2.014  1.00  0.00           H  
HETATM   46  H14 UNL     1      -0.192  -1.748  -1.646  1.00  0.00           H  
HETATM   47  H15 UNL     1      -4.279   2.044   1.792  1.00  0.00           H  
HETATM   48  H16 UNL     1      -5.331   4.975   1.742  1.00  0.00           H  
HETATM   49  H17 UNL     1      -2.436   5.897   1.279  1.00  0.00           H  
HETATM   50  H18 UNL     1      -0.252   5.970   0.074  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   32
CONECT    3    4   14   14
CONECT    4    5
CONECT    5    6   12   33
CONECT    6    7
CONECT    7    8   34   35
CONECT    8    9   10   36
CONECT    9   37
CONECT   10   11   12   38
CONECT   11   39
CONECT   12   13   40
CONECT   13   41
CONECT   14   15   24
CONECT   15   16   16   23
CONECT   16   17   42
CONECT   17   18   19   19
CONECT   18   43
CONECT   19   20   21
CONECT   20   44
CONECT   21   22   23   23
CONECT   22   45
CONECT   23   46
CONECT   24   25
CONECT   25   26   26   32
CONECT   26   27   47
CONECT   27   28   29   29
CONECT   28   48
CONECT   29   30   49
CONECT   30   31   32   32
CONECT   31   50
END

HMDB0041635
     RDKit          3D
Myricetin 3-arabinoside
 50 53  0  0  0  0  0  0  0  0999 V2000
    0.5554    2.9189   -0.7778 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3917    2.2118   -0.3451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4173    0.8354   -0.5120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6486    0.2923   -1.1651 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.8514   -0.0647   -0.4440 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6840    1.0723   -0.6830 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7897    1.0200    0.1715 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3104   -0.4227    0.2611 C   0  0  2  0  0  0  0  0  0  0  0  0
    5.6524   -0.4665    0.5455 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9844   -1.0418   -1.1041 C   0  0  2  0  0  0  0  0  0  0  0  0
    4.2215   -0.0697   -2.0629 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.4617   -1.2594   -1.0889 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.2300   -2.4321   -0.3546 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4553    0.1215   -0.0335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6127   -1.3180   -0.1414 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5784   -1.9462    0.6380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8391   -3.3034    0.5742 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8241   -3.8334    1.3950 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1315   -4.1085   -0.2892 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3642   -5.4737   -0.3809 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1625   -3.5126   -1.0804 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4526   -4.3161   -1.9457 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9244   -2.1405   -0.9922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4262    0.7792    0.5937 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    2.0668    0.7702 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4808    2.6862    1.4335 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4966    4.0493    1.6231 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5548    4.6695    2.2938 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4437    4.8280    1.1411 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3899    4.2313    0.4760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3188    4.9836   -0.0197 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4056    2.8665    0.3037 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6726   -0.1405    0.6405 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5969    1.5992   -0.3226 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6039    1.4526    1.1552 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6686   -0.9524    0.9929 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9486    0.4188    0.8379 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5281   -1.9719   -1.2768 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0545    0.4307   -1.9325 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0980   -1.3664   -2.1501 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9436   -3.1299   -1.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1563   -1.3430    1.3321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0845   -4.7878    1.4239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0490   -5.9705    0.1607 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6182   -5.3006   -2.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1925   -1.7479   -1.6456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2790    2.0437    1.7920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3305    4.9750    1.7419 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4358    5.8975    1.2785 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2523    5.9701    0.0742 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
  8 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  1  0
 17 19  2  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 21 23  2  0
 14 24  1  0
 24 25  1  0
 25 26  2  0
 26 27  1  0
 27 28  1  0
 27 29  2  0
 29 30  1  0
 30 31  1  0
 30 32  2  0
 32  2  1  0
 12  5  1  0
 23 15  1  0
 32 25  1  0
  5 33  1  1
  7 34  1  0
  7 35  1  0
  8 36  1  1
  9 37  1  0
 10 38  1  6
 11 39  1  0
 12 40  1  6
 13 41  1  0
 16 42  1  0
 18 43  1  0
 20 44  1  0
 22 45  1  0
 23 46  1  0
 26 47  1  0
 28 48  1  0
 29 49  1  0
 31 50  1  0
M  END

View in JSmol View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₀H₁₈O₁₂

Average Molecular Weight

450.3497

Monoisotopic Molecular Weight

450.07982604

IUPAC Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)-4H-chromen-4-one

Traditional Name

5,7-dihydroxy-3-{[(2S,3R,4S,5S)-3,4,5-trihydroxyoxan-2-yl]oxy}-2-(3,4,5-trihydroxyphenyl)chromen-4-one

CAS Registry Number

132679-85-7

SMILES

O[C@H]1CO[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O

InChI Identifier

InChI=1S/C20H18O12/c21-7-3-8(22)13-12(4-7)31-18(6-1-9(23)14(26)10(24)2-6)19(16(13)28)32-20-17(29)15(27)11(25)5-30-20/h1-4,11,15,17,20-27,29H,5H2/t11-,15-,17+,20-/m0/s1

InChI Key

SBEOEJNITMVWLK-KJCLSZHRSA-N

Chemical Taxonomy

Description

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

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-3-O-glycosides

Alternative Parents

Substituents

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

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0041635)
Cytoplasm (HMDB: HMDB0041635)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0041635)

Source

Exogenous

Exogenous (HMDB: HMDB0041635)

Food

Food (HMDB: HMDB0041635)

Fruit

Berry

American cranberry (FooDB: FOOD00192)

Endogenous

Plant

Plant (HMDB: HMDB0041635)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0041635)

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	203 - 205 °C	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	1.83 g/L	ALOGPS
logP	0.69	ALOGPS
logP	0.18	ChemAxon
logS	-2.4	ALOGPS
pKa (Strongest Acidic)	6.43	ChemAxon
pKa (Strongest Basic)	-3.5	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	8	ChemAxon
Polar Surface Area	206.6 Å²	ChemAxon
Rotatable Bond Count	3	ChemAxon
Refractivity	105.29 m³·mol⁻¹	ChemAxon
Polarizability	41.67 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
DeepCCS	[M+H]+	195.901	30932474
DeepCCS	[M-H]-	193.505	30932474
DeepCCS	[M-2H]-	226.61	30932474
DeepCCS	[M+Na]+	201.813	30932474
AllCCS	[M+H]+	201.4	32859911
AllCCS	[M+H-H2O]+	198.9	32859911
AllCCS	[M+NH4]+	203.7	32859911
AllCCS	[M+Na]+	204.4	32859911
AllCCS	[M-H]-	198.7	32859911
AllCCS	[M+Na-2H]-	198.8	32859911
AllCCS	[M+HCOO]-	199.1	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Myricetin 3-arabinoside	O[C@H]1CO[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	5884.7	Standard polar	33892256
Myricetin 3-arabinoside	O[C@H]1CO[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4150.3	Standard non polar	33892256
Myricetin 3-arabinoside	O[C@H]1CO[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC(O)=C(O)C(O)=C2)[C@H](O)[C@H]1O	4314.4	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Myricetin 3-arabinoside,1TMS,isomer #1	C[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O	4308.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4271.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4333.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #4	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4263.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #5	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4259.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)OC[C@H](O)[C@@H]1O	4299.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TMS,isomer #7	C[Si](C)(C)O[C@H]1[C@@H](O)CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O	4301.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #1	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4163.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4190.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4195.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4219.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4232.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4183.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #15	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4177.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #16	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4148.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #17	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4159.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #18	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4153.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #19	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4117.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #2	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4148.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #20	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4129.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #21	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4144.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #22	C[Si](C)(C)O[C@H]1[C@@H](O)CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O[Si](C)(C)C	4232.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4232.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4199.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #5	C[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@H]1O	4252.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #6	C[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C	4243.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #7	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4205.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #8	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O	4165.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TMS,isomer #9	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4170.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #1	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4080.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #10	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4096.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #11	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4128.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4139.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4167.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4126.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #15	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4151.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #16	C[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=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)C	4168.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #17	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4104.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #18	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4123.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #19	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4038.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #2	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O	4080.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #20	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4045.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #21	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4066.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #22	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4079.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #23	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4037.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #24	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4010.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #25	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4035.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #26	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4048.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #27	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4121.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4140.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #29	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4065.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #3	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4090.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #30	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4034.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #31	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4086.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #32	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4051.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #33	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4040.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4018.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #35	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4088.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #36	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4067.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #37	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4034.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #38	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4082.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #39	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4049.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #4	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4113.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #40	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4051.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #41	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4074.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #5	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4077.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #6	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4047.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #7	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4051.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #8	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4052.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TMS,isomer #9	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4074.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #1	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3961.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #10	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O	4073.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #11	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4011.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #12	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4000.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #13	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	4032.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #14	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	4026.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #15	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4026.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #16	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3988.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3970.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3989.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #19	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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	3966.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4010.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #20	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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	3987.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #21	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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	4050.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4069.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #23	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4086.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #24	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4119.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #25	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4097.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #26	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4072.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #27	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3923.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #28	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3983.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #29	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3962.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4033.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #30	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3980.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #31	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3960.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #32	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3951.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #33	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4012.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #34	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O	3932.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #35	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O[Si](C)(C)C	3920.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #36	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O	3968.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #37	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O[Si](C)(C)C	3954.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #38	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3955.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #39	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	3977.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #4	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3963.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4024.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3975.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #42	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3933.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #43	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3928.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #44	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3973.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3962.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #46	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3976.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #47	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O	4021.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #48	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O[Si](C)(C)C	4010.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #49	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3994.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3956.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #50	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4029.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #6	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O	4001.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #7	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O	4024.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #8	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O	3959.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,4TMS,isomer #9	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C	3947.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #1	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3917.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3957.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #11	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O	3981.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #12	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O	3908.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #13	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O[Si](C)(C)C	3912.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #14	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O	3910.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #15	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O[Si](C)(C)C	3918.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #16	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3936.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #17	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O	3993.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #18	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O[Si](C)(C)C	3991.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #19	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3972.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #2	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3923.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #20	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3988.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #21	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3974.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3972.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #23	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3968.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #24	C[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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	3951.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #25	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4046.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #26	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3919.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #27	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3966.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #28	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3933.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #29	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3931.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #3	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3937.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #30	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3926.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #31	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3929.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #32	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3932.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #33	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O	3915.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #34	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O[Si](C)(C)C	3916.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #35	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3903.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #36	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3939.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #37	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3931.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3933.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #39	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3920.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #4	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3932.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3961.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #41	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3988.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #5	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3992.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #6	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3921.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #7	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3927.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #8	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3929.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,5TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3936.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #1	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3940.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #10	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3943.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #11	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O	3939.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #12	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O)=C1O[Si](C)(C)C	3943.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #13	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3934.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #14	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3930.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #15	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3999.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #16	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3971.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #17	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3942.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #18	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3935.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #19	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3923.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #2	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3947.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #20	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3925.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #21	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O[Si](C)(C)C)=C1O[Si](C)(C)C	3937.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #22	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3948.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #3	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3939.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #4	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3932.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #5	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3926.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #6	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3927.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #7	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3950.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #8	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3952.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,6TMS,isomer #9	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3944.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O	4557.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4556.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4583.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4553.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4559.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)OC[C@H](O)[C@@H]1O	4543.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O	4555.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4657.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4657.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4660.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4683.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4691.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4648.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4667.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4630.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4636.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4640.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4617.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4663.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4642.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4642.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)O[C@H]1[C@@H](O)CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@@H]1O[Si](C)(C)C(C)(C)C	4690.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4706.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4684.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=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	4703.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4701.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4673.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O	4635.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4651.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4749.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[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	4738.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4783.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4796.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4800.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C(C1=CC(O)=C(O)C(O)=C1)O2	4772.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4772.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)O[C@H]1CO[C@@H](OC2=C(C3=CC(O)=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)C	4814.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4757.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4767.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4733.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O	4730.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4790.5	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4703.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4716.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4717.9	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4710.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4739.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4737.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC(O)=C(O)C(O)=C1)O2	4761.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O)C(O)=C3)OC2=C1	4785.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4721.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4747.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4754.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4736.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4753.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4738.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4730.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[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(O)=C1O	4736.4	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4709.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4701.8	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4720.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4714.0	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O	4754.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C	4717.3	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O)[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	4732.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4735.1	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4727.7	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4764.6	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[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	4755.2	Semi standard non polar	33892256
Myricetin 3-arabinoside,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C2=C(O[C@@H]3OC[C@H](O[Si](C)(C)C(C)(C)C)[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	4736.3	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 - Myricetin 3-arabinoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-05ai-9405600000-7a3742ebe9fdf8c3cf59	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricetin 3-arabinoside GC-MS (3 TMS) - 70eV, Positive	splash10-0udi-4610039000-34e8e79ba557210e7248	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Myricetin 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 - Myricetin 3-arabinoside 10V, Positive-QTOF	splash10-0gb9-0109600000-4f217d852feaa6b2db41	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 20V, Positive-QTOF	splash10-014i-0119100000-810e8c6eec6cfe2a9ba6	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 40V, Positive-QTOF	splash10-0udr-2924000000-99b787b1d3590d3ac849	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 10V, Negative-QTOF	splash10-00kb-1115900000-e17e93d6c0cf28275789	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 20V, Negative-QTOF	splash10-014j-1339300000-a811ba6b36ca8af0b4b4	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 40V, Negative-QTOF	splash10-004l-6941000000-af2eb0873630419236d9	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 10V, Negative-QTOF	splash10-0002-0000900000-69a6df4817caa75dd562	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 20V, Negative-QTOF	splash10-0f6t-0300900000-3166238da89a5bb719d9	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 40V, Negative-QTOF	splash10-0udl-1910200000-f97ab6e612a5c24dd143	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 10V, Positive-QTOF	splash10-0udi-0000900000-a8b862d11b424a74dae1	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 20V, Positive-QTOF	splash10-0udi-0000900000-5794fb68ba4d07695a4d	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Myricetin 3-arabinoside 40V, Positive-QTOF	splash10-0udi-1910400000-0e3d9459af73c4d8e8a3	2021-09-23	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

FDB021864

KNApSAcK ID

Not Available

Chemspider ID

10283343

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

21672568

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 Myricetin 3-arabinoside (HMDB0041635)

MOL for HMDB0041635 (Myricetin 3-arabinoside)

3D MOL for HMDB0041635 (Myricetin 3-arabinoside)

3D SDF for HMDB0041635 (Myricetin 3-arabinoside)

3D-SDF for HMDB0041635 (Myricetin 3-arabinoside)

PDB for HMDB0041635 (Myricetin 3-arabinoside)

3D PDB for HMDB0041635 (Myricetin 3-arabinoside)

SMILES for HMDB0041635 (Myricetin 3-arabinoside)

INCHI for HMDB0041635 (Myricetin 3-arabinoside)

Structure for HMDB0041635 (Myricetin 3-arabinoside)

3D Structure for HMDB0041635 (Myricetin 3-arabinoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra