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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 22:49:34 UTC

Update Date

2022-03-07 02:55:24 UTC

HMDB ID

HMDB0037575

Secondary Accession Numbers

HMDB37575

Metabolite Identification

Common Name

Kaempferol 3-arabinofuranoside 7-rhamnofuranoside

Description

Kaempferol 3-arabinofuranoside 7-rhamnofuranoside belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Kaempferol 3-arabinofuranoside 7-rhamnofuranoside has been detected, but not quantified in, several different foods, such as alcoholic beverages, beverages, fruits, and herbs and spices. This could make kaempferol 3-arabinofuranoside 7-rhamnofuranoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Kaempferol 3-arabinofuranoside 7-rhamnofuranoside.

Structure

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

  Mrv0541 05061309522D          

 40 44  0  0  0  0            999 V2000
   -4.7545   -1.2712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9605   -4.4120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2696   -0.6038    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4454   -3.7445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2704   -3.7445    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0366   -1.4045    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5253   -2.9599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2296   -1.2330    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4491   -0.6900    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2960   -5.1657    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6052    0.1499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.7553   -4.4120    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3722   -2.1582    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.3099   -2.7050    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6166   -1.7850    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1904   -2.9599    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8971   -0.0769    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  2  1  0  0  0  0
  5  3  2  0  0  0  0
  9  1  1  0  0  0  0
 10  2  2  0  0  0  0
 10  3  1  0  0  0  0
 11  4  2  0  0  0  0
 11  5  1  0  0  0  0
 12  6  2  0  0  0  0
 12  7  1  0  0  0  0
 13  6  1  0  0  0  0
 14  7  2  0  0  0  0
 15  8  1  0  0  0  0
 16 13  2  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
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 21 19  1  0  0  0  0
 22  9  1  0  0  0  0
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 23 10  1  0  0  0  0
 24 18  1  0  0  0  0
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 25 21  1  0  0  0  0
 26 20  1  0  0  0  0
 27  8  1  0  0  0  0
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 29 11  1  0  0  0  0
 30 13  1  0  0  0  0
 31 17  1  0  0  0  0
 32 18  2  0  0  0  0
 33 19  1  0  0  0  0
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 36 12  1  0  0  0  0
 36 25  1  0  0  0  0
 37 14  1  0  0  0  0
 37 23  1  0  0  0  0
 38 15  1  0  0  0  0
 38 26  1  0  0  0  0
 39 22  1  0  0  0  0
 39 25  1  0  0  0  0
 40 24  1  0  0  0  0
 40 26  1  0  0  0  0
M  END

HMDB0037575
     RDKit          3D
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside
 68 72  0  0  0  0  0  0  0  0999 V2000
    8.2956    0.9446   -1.4707 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1608   -0.1274   -0.4107 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2011   -0.0363    0.5160 O   0  0  0  0  0  0  0  0  0  0  0  0
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    4.7513   -0.6418    0.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0303    0.2782    0.9004 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6687    0.4850    0.8197 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1347    1.4615    1.6717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7862    1.7088    1.6337 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2354    2.6705    2.4676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0476    1.0173    0.7770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3999    1.2323    0.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9340    2.0894    1.4460 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2330    0.5167   -0.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.1353    1.3422    1.7095 C   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.7987   -2.3488   -2.4576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4008   -3.1476   -3.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6638   -2.8569   -3.8683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2716   -3.6749   -4.8280 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2849   -1.7467   -3.3567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6576   -0.9363   -2.3922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3309   -0.6060   -0.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4519    0.0493   -0.0740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8220   -0.1903   -0.0239 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4902   -1.6458    1.0287 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7243   -2.0882    2.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6787   -0.8103    1.4543 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -1.5974    1.6460 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3517    1.1272   -1.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7064    0.5694   -2.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
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    8.1794   -1.1183   -0.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
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    4.1346   -1.2252   -0.5585 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8262    1.9689    2.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8285    3.1880    3.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.5447   -0.7007    2.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -1.9128   -4.0262   -3.8077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8413   -4.4600   -4.6020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2732   -1.4961   -3.7052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1708   -0.0668   -2.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
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    5.8580   -2.4781    0.3931 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9891   -3.0356    2.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4261   -0.3062    2.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3462   -1.2248    2.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
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 37 65  1  0
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 39 67  1  0
 40 68  1  0
M  END

  Mrv0541 05061309522D          

 40 44  0  0  0  0            999 V2000
   -4.7545   -1.2712    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    1.9605   -4.4120    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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 12  7  1  0  0  0  0
 13  6  1  0  0  0  0
 14  7  2  0  0  0  0
 15  8  1  0  0  0  0
 16 13  2  0  0  0  0
 16 14  1  0  0  0  0
 17 15  1  0  0  0  0
 18 16  1  0  0  0  0
 20 17  1  0  0  0  0
 21 19  1  0  0  0  0
 22  9  1  0  0  0  0
 22 19  1  0  0  0  0
 23 10  1  0  0  0  0
 24 18  1  0  0  0  0
 24 23  2  0  0  0  0
 25 21  1  0  0  0  0
 26 20  1  0  0  0  0
 27  8  1  0  0  0  0
 28  9  1  0  0  0  0
 29 11  1  0  0  0  0
 30 13  1  0  0  0  0
 31 17  1  0  0  0  0
 32 18  2  0  0  0  0
 33 19  1  0  0  0  0
 34 20  1  0  0  0  0
 35 21  1  0  0  0  0
 36 12  1  0  0  0  0
 36 25  1  0  0  0  0
 37 14  1  0  0  0  0
 37 23  1  0  0  0  0
 38 15  1  0  0  0  0
 38 26  1  0  0  0  0
 39 22  1  0  0  0  0
 39 25  1  0  0  0  0
 40 24  1  0  0  0  0
 40 26  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0037575

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C26H28O14/c1-9(28)22-19(33)21(35)25(39-22)36-12-6-13(30)16-14(7-12)37-23(10-2-4-11(29)5-3-10)24(18(16)32)40-26-20(34)17(31)15(8-27)38-26/h2-7,9,15,17,19-22,25-31,33-35H,8H2,1H3

> <INCHI_KEY>
POYDZVHXYJSOOS-UHFFFAOYSA-N

> <FORMULA>
C26H28O14

> <MOLECULAR_WEIGHT>
564.4921

> <EXACT_MASS>
564.147905604

> <JCHEM_ACCEPTOR_COUNT>
14

> <JCHEM_AVERAGE_POLARIZABILITY>
54.07580997815951

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
7-{[3,4-dihydroxy-5-(1-hydroxyethyl)oxolan-2-yl]oxy}-3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

> <ALOGPS_LOGP>
0.25

> <JCHEM_LOGP>
-0.4320931589999991

> <ALOGPS_LOGS>
-2.52

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.738038096958073

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.102019328391627

> <JCHEM_PKA_STRONGEST_BASIC>
-2.981152416465515

> <JCHEM_POLAR_SURFACE_AREA>
225.05999999999992

> <JCHEM_REFRACTIVITY>
131.93279999999993

> <JCHEM_ROTATABLE_BOND_COUNT>
7

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.70e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
7-{[3,4-dihydroxy-5-(1-hydroxyethyl)oxolan-2-yl]oxy}-3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037575
     RDKit          3D
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside
 68 72  0  0  0  0  0  0  0  0999 V2000
    8.2956    0.9446   -1.4707 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1608   -0.1274   -0.4107 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2011   -0.0363    0.5160 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8391    0.1360    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7564    0.0691   -0.5108 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7513   -0.6418    0.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0303    0.2782    0.9004 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6687    0.4850    0.8197 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1347    1.4615    1.6717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7862    1.7088    1.6337 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2354    2.6705    2.4676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0476    1.0173    0.7770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3999    1.2323    0.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9340    2.0894    1.4460 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2330    0.5167   -0.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6113    0.8166   -0.1428 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4514    0.1509    0.7958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7833    1.1256    1.7403 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1353    1.3422    1.7095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5743    2.3195    0.6497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9483    2.4654    0.7026 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6876   -0.0316    1.3893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9907    0.0259    0.9189 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7077   -0.4138    0.2648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7266   -1.8070    0.2175 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6517   -0.4108   -0.9680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4144   -1.2086   -1.9188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7987   -2.3488   -2.4576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4008   -3.1476   -3.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6638   -2.8569   -3.8683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2716   -3.6749   -4.8280 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2849   -1.7467   -3.3567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6576   -0.9363   -2.3922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3309   -0.6060   -0.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4519    0.0493   -0.0740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8220   -0.1903   -0.0239 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4902   -1.6458    1.0287 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7243   -2.0882    2.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6787   -0.8103    1.4543 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -1.5974    1.6460 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3517    1.1272   -1.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7064    0.5694   -2.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7954    1.8539   -1.0882 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1794   -1.1183   -0.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1392    0.9009    0.8840 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8853    1.1741    0.7301 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1346   -1.2252   -0.5585 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8262    1.9689    2.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8285    3.1880    3.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8723   -0.6677    1.3140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4850    1.7037    2.7000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1062    3.3095    0.8667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2852    2.0109   -0.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3185    2.4217    1.6187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5447   -0.7007    2.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4309   -0.8355    1.0870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0969    0.0092   -0.6646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6742   -2.1210    1.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7971   -2.5945   -2.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9128   -4.0262   -3.8077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8413   -4.4600   -4.6020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2732   -1.4961   -3.7052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1708   -0.0668   -2.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1985   -0.9564   -0.7011 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8580   -2.4781    0.3931 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9891   -3.0356    2.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4261   -0.3062    2.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3462   -1.2248    2.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 19 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 15 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  2  0
 26 34  1  0
 34 35  1  0
 35 36  2  0
  6 37  1  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 39  4  1  0
 36  8  1  0
 35 12  1  0
 24 17  1  0
 33 27  1  0
  1 41  1  0
  1 42  1  0
  1 43  1  0
  2 44  1  0
  3 45  1  0
  4 46  1  0
  6 47  1  0
  9 48  1  0
 11 49  1  0
 17 50  1  0
 19 51  1  0
 20 52  1  0
 20 53  1  0
 21 54  1  0
 22 55  1  0
 23 56  1  0
 24 57  1  0
 25 58  1  0
 28 59  1  0
 29 60  1  0
 31 61  1  0
 32 62  1  0
 33 63  1  0
 36 64  1  0
 37 65  1  0
 38 66  1  0
 39 67  1  0
 40 68  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      -8.875  -2.373   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       3.660  -8.236   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -7.970  -1.127   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       4.565  -6.990   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0       6.105  -6.990   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -5.668  -2.622   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       6.581  -5.525   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -4.162  -2.302   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      -6.438  -1.288   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       4.286  -9.643   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      -8.596   0.280   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       9.336   2.310   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       7.010  -8.236   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0       2.667  -4.620   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      -6.295  -4.029   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       8.045  -5.049   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0      -3.018  -3.332   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      -2.667   0.000   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0       2.667   0.000   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0       4.089  -5.525   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0      -5.408  -0.144   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
CONECT    1    9                                                            
CONECT    2    4   10                                                       
CONECT    3    5   10                                                       
CONECT    4    2   11                                                       
CONECT    5    3   11                                                       
CONECT    6   12   13                                                       
CONECT    7   12   14                                                       
CONECT    8   15   27                                                       
CONECT    9    1   22   28                                                  
CONECT   10    2    3   23                                                  
CONECT   11    4    5   29                                                  
CONECT   12    6    7   36                                                  
CONECT   13    6   16   30                                                  
CONECT   14    7   16   37                                                  
CONECT   15    8   17   38                                                  
CONECT   16   13   14   18                                                  
CONECT   17   15   20   31                                                  
CONECT   18   16   24   32                                                  
CONECT   19   21   22   33                                                  
CONECT   20   17   26   34                                                  
CONECT   21   19   25   35                                                  
CONECT   22    9   19   39                                                  
CONECT   23   10   24   37                                                  
CONECT   24   18   23   40                                                  
CONECT   25   21   36   39                                                  
CONECT   26   20   38   40                                                  
CONECT   27    8                                                            
CONECT   28    9                                                            
CONECT   29   11                                                            
CONECT   30   13                                                            
CONECT   31   17                                                            
CONECT   32   18                                                            
CONECT   33   19                                                            
CONECT   34   20                                                            
CONECT   35   21                                                            
CONECT   36   12   25                                                       
CONECT   37   14   23                                                       
CONECT   38   15   26                                                       
CONECT   39   22   25                                                       
CONECT   40   24   26                                                       
MASTER        0    0    0    0    0    0    0    0   40    0   88    0
END

COMPND    HMDB0037575
HETATM    1  C1  UNL     1       8.296   0.945  -1.471  1.00  0.00           C  
HETATM    2  C2  UNL     1       8.161  -0.127  -0.411  1.00  0.00           C  
HETATM    3  O1  UNL     1       9.201  -0.036   0.516  1.00  0.00           O  
HETATM    4  C3  UNL     1       6.839   0.136   0.316  1.00  0.00           C  
HETATM    5  O2  UNL     1       5.756   0.069  -0.511  1.00  0.00           O  
HETATM    6  C4  UNL     1       4.751  -0.642   0.143  1.00  0.00           C  
HETATM    7  O3  UNL     1       4.030   0.278   0.900  1.00  0.00           O  
HETATM    8  C5  UNL     1       2.669   0.485   0.820  1.00  0.00           C  
HETATM    9  C6  UNL     1       2.135   1.461   1.672  1.00  0.00           C  
HETATM   10  C7  UNL     1       0.786   1.709   1.634  1.00  0.00           C  
HETATM   11  O4  UNL     1       0.235   2.670   2.468  1.00  0.00           O  
HETATM   12  C8  UNL     1      -0.048   1.017   0.777  1.00  0.00           C  
HETATM   13  C9  UNL     1      -1.400   1.232   0.710  1.00  0.00           C  
HETATM   14  O5  UNL     1      -1.934   2.089   1.446  1.00  0.00           O  
HETATM   15  C10 UNL     1      -2.233   0.517  -0.168  1.00  0.00           C  
HETATM   16  O6  UNL     1      -3.611   0.817  -0.143  1.00  0.00           O  
HETATM   17  C11 UNL     1      -4.451   0.151   0.796  1.00  0.00           C  
HETATM   18  O7  UNL     1      -4.783   1.126   1.740  1.00  0.00           O  
HETATM   19  C12 UNL     1      -6.135   1.342   1.710  1.00  0.00           C  
HETATM   20  C13 UNL     1      -6.574   2.320   0.650  1.00  0.00           C  
HETATM   21  O8  UNL     1      -7.948   2.465   0.703  1.00  0.00           O  
HETATM   22  C14 UNL     1      -6.688  -0.032   1.389  1.00  0.00           C  
HETATM   23  O9  UNL     1      -7.991   0.026   0.919  1.00  0.00           O  
HETATM   24  C15 UNL     1      -5.708  -0.414   0.265  1.00  0.00           C  
HETATM   25  O10 UNL     1      -5.727  -1.807   0.217  1.00  0.00           O  
HETATM   26  C16 UNL     1      -1.652  -0.411  -0.968  1.00  0.00           C  
HETATM   27  C17 UNL     1      -2.414  -1.209  -1.919  1.00  0.00           C  
HETATM   28  C18 UNL     1      -1.799  -2.349  -2.458  1.00  0.00           C  
HETATM   29  C19 UNL     1      -2.401  -3.148  -3.400  1.00  0.00           C  
HETATM   30  C20 UNL     1      -3.664  -2.857  -3.868  1.00  0.00           C  
HETATM   31  O11 UNL     1      -4.272  -3.675  -4.828  1.00  0.00           O  
HETATM   32  C21 UNL     1      -4.285  -1.747  -3.357  1.00  0.00           C  
HETATM   33  C22 UNL     1      -3.658  -0.936  -2.392  1.00  0.00           C  
HETATM   34  O12 UNL     1      -0.331  -0.606  -0.885  1.00  0.00           O  
HETATM   35  C23 UNL     1       0.452   0.049  -0.074  1.00  0.00           C  
HETATM   36  C24 UNL     1       1.822  -0.190  -0.024  1.00  0.00           C  
HETATM   37  C25 UNL     1       5.490  -1.646   1.029  1.00  0.00           C  
HETATM   38  O13 UNL     1       4.724  -2.088   2.081  1.00  0.00           O  
HETATM   39  C26 UNL     1       6.679  -0.810   1.454  1.00  0.00           C  
HETATM   40  O14 UNL     1       7.823  -1.597   1.646  1.00  0.00           O  
HETATM   41  H1  UNL     1       9.352   1.127  -1.756  1.00  0.00           H  
HETATM   42  H2  UNL     1       7.706   0.569  -2.354  1.00  0.00           H  
HETATM   43  H3  UNL     1       7.795   1.854  -1.088  1.00  0.00           H  
HETATM   44  H4  UNL     1       8.179  -1.118  -0.870  1.00  0.00           H  
HETATM   45  H5  UNL     1       9.139   0.901   0.884  1.00  0.00           H  
HETATM   46  H6  UNL     1       6.885   1.174   0.730  1.00  0.00           H  
HETATM   47  H7  UNL     1       4.135  -1.225  -0.558  1.00  0.00           H  
HETATM   48  H8  UNL     1       2.826   1.969   2.317  1.00  0.00           H  
HETATM   49  H9  UNL     1       0.829   3.188   3.102  1.00  0.00           H  
HETATM   50  H10 UNL     1      -3.872  -0.668   1.314  1.00  0.00           H  
HETATM   51  H11 UNL     1      -6.485   1.704   2.700  1.00  0.00           H  
HETATM   52  H12 UNL     1      -6.106   3.309   0.867  1.00  0.00           H  
HETATM   53  H13 UNL     1      -6.285   2.011  -0.354  1.00  0.00           H  
HETATM   54  H14 UNL     1      -8.318   2.422   1.619  1.00  0.00           H  
HETATM   55  H15 UNL     1      -6.545  -0.701   2.240  1.00  0.00           H  
HETATM   56  H16 UNL     1      -8.431  -0.835   1.087  1.00  0.00           H  
HETATM   57  H17 UNL     1      -6.097   0.009  -0.665  1.00  0.00           H  
HETATM   58  H18 UNL     1      -5.674  -2.121   1.163  1.00  0.00           H  
HETATM   59  H19 UNL     1      -0.797  -2.595  -2.097  1.00  0.00           H  
HETATM   60  H20 UNL     1      -1.913  -4.026  -3.808  1.00  0.00           H  
HETATM   61  H21 UNL     1      -4.841  -4.460  -4.602  1.00  0.00           H  
HETATM   62  H22 UNL     1      -5.273  -1.496  -3.705  1.00  0.00           H  
HETATM   63  H23 UNL     1      -4.171  -0.067  -2.055  1.00  0.00           H  
HETATM   64  H24 UNL     1       2.198  -0.956  -0.701  1.00  0.00           H  
HETATM   65  H25 UNL     1       5.858  -2.478   0.393  1.00  0.00           H  
HETATM   66  H26 UNL     1       4.989  -3.036   2.259  1.00  0.00           H  
HETATM   67  H27 UNL     1       6.426  -0.306   2.415  1.00  0.00           H  
HETATM   68  H28 UNL     1       8.346  -1.225   2.401  1.00  0.00           H  
CONECT    1    2   41   42   43
CONECT    2    3    4   44
CONECT    3   45
CONECT    4    5   39   46
CONECT    5    6
CONECT    6    7   37   47
CONECT    7    8
CONECT    8    9    9   36
CONECT    9   10   48
CONECT   10   11   12   12
CONECT   11   49
CONECT   12   13   35
CONECT   13   14   14   15
CONECT   15   16   26   26
CONECT   16   17
CONECT   17   18   24   50
CONECT   18   19
CONECT   19   20   22   51
CONECT   20   21   52   53
CONECT   21   54
CONECT   22   23   24   55
CONECT   23   56
CONECT   24   25   57
CONECT   25   58
CONECT   26   27   34
CONECT   27   28   28   33
CONECT   28   29   59
CONECT   29   30   30   60
CONECT   30   31   32
CONECT   31   61
CONECT   32   33   33   62
CONECT   33   63
CONECT   34   35
CONECT   35   36   36
CONECT   36   64
CONECT   37   38   39   65
CONECT   38   66
CONECT   39   40   67
CONECT   40   68
END

HMDB0037575
     RDKit          3D
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside
 68 72  0  0  0  0  0  0  0  0999 V2000
    8.2956    0.9446   -1.4707 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1608   -0.1274   -0.4107 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.2011   -0.0363    0.5160 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8391    0.1360    0.3157 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7564    0.0691   -0.5108 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.7513   -0.6418    0.1433 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0303    0.2782    0.9004 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6687    0.4850    0.8197 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1347    1.4615    1.6717 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7862    1.7088    1.6337 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2354    2.6705    2.4676 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0476    1.0173    0.7770 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3999    1.2323    0.7104 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9340    2.0894    1.4460 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2330    0.5167   -0.1676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6113    0.8166   -0.1428 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4514    0.1509    0.7958 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7833    1.1256    1.7403 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1353    1.3422    1.7095 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5743    2.3195    0.6497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9483    2.4654    0.7026 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6876   -0.0316    1.3893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9907    0.0259    0.9189 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7077   -0.4138    0.2648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7266   -1.8070    0.2175 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6517   -0.4108   -0.9680 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4144   -1.2086   -1.9188 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7987   -2.3488   -2.4576 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4008   -3.1476   -3.4005 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6638   -2.8569   -3.8683 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2716   -3.6749   -4.8280 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2849   -1.7467   -3.3567 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6576   -0.9363   -2.3922 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3309   -0.6060   -0.8851 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4519    0.0493   -0.0740 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8220   -0.1903   -0.0239 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4902   -1.6458    1.0287 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7243   -2.0882    2.0813 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6787   -0.8103    1.4543 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8231   -1.5974    1.6460 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.3517    1.1272   -1.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7064    0.5694   -2.3541 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7954    1.8539   -1.0882 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1794   -1.1183   -0.8700 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.1392    0.9009    0.8840 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8853    1.1741    0.7301 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1346   -1.2252   -0.5585 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8262    1.9689    2.3170 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8285    3.1880    3.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8723   -0.6677    1.3140 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4850    1.7037    2.7000 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1062    3.3095    0.8667 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2852    2.0109   -0.3545 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3185    2.4217    1.6187 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5447   -0.7007    2.2399 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4309   -0.8355    1.0870 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0969    0.0092   -0.6646 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6742   -2.1210    1.1629 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7971   -2.5945   -2.0974 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9128   -4.0262   -3.8077 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8413   -4.4600   -4.6020 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2732   -1.4961   -3.7052 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1708   -0.0668   -2.0552 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1985   -0.9564   -0.7011 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8580   -2.4781    0.3931 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9891   -3.0356    2.2591 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4261   -0.3062    2.4149 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3462   -1.2248    2.4008 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  2  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  2  0
  9 10  1  0
 10 11  1  0
 10 12  2  0
 12 13  1  0
 13 14  2  0
 13 15  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 19 22  1  0
 22 23  1  0
 22 24  1  0
 24 25  1  0
 15 26  2  0
 26 27  1  0
 27 28  2  0
 28 29  1  0
 29 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  2  0
 26 34  1  0
 34 35  1  0
 35 36  2  0
  6 37  1  0
 37 38  1  0
 37 39  1  0
 39 40  1  0
 39  4  1  0
 36  8  1  0
 35 12  1  0
 24 17  1  0
 33 27  1  0
  1 41  1  0
  1 42  1  0
  1 43  1  0
  2 44  1  0
  3 45  1  0
  4 46  1  0
  6 47  1  0
  9 48  1  0
 11 49  1  0
 17 50  1  0
 19 51  1  0
 20 52  1  0
 20 53  1  0
 21 54  1  0
 22 55  1  0
 23 56  1  0
 24 57  1  0
 25 58  1  0
 28 59  1  0
 29 60  1  0
 31 61  1  0
 32 62  1  0
 33 63  1  0
 36 64  1  0
 37 65  1  0
 38 66  1  0
 39 67  1  0
 40 68  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Kaempferol-3-O-arabinofuranoside-7-O-rhamnopyranoside	MeSH
Kempferol-3-O-arabinofuranoside-7-O-rhamnopyranoside	MeSH
Kaempefrol-3-O-arabinofuranoside-7-O-rhamnopyranoside	HMDB
Kafrp	HMDB
Ternoside	HMDB

Chemical Formula

C₂₆H₂₈O₁₄

Average Molecular Weight

564.4921

Monoisotopic Molecular Weight

564.147905604

IUPAC Name

7-{[3,4-dihydroxy-5-(1-hydroxyethyl)oxolan-2-yl]oxy}-3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-4H-chromen-4-one

Traditional Name

7-{[3,4-dihydroxy-5-(1-hydroxyethyl)oxolan-2-yl]oxy}-3-{[3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)chromen-4-one

CAS Registry Number

27509-67-7

SMILES

CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C1O

InChI Identifier

InChI=1S/C26H28O14/c1-9(28)22-19(33)21(35)25(39-22)36-12-6-13(30)16-14(7-12)37-23(10-2-4-11(29)5-3-10)24(18(16)32)40-26-20(34)17(31)15(8-27)38-26/h2-7,9,15,17,19-22,25-31,33-35H,8H2,1H3

InChI Key

POYDZVHXYJSOOS-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position.

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-7-O-glycosides

Alternative Parents

Substituents

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

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0037575)
Cytoplasm (HMDB: HMDB0037575)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0037575)

Source

Exogenous

Exogenous (HMDB: HMDB0037575)

Food

Food (HMDB: HMDB0037575)

Herb and spice

Herbs and Spices (FooDB: FOOD00866)

Fruit

Fruits (FooDB: FOOD00871)

Beverage

Alcoholic beverage

Alcoholic beverages (FooDB: FOOD00854)

Beverages (FooDB: FOOD00870)

Endogenous

Plant

Plant (HMDB: HMDB0037575)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0037575)

Physical Properties

State

Not Available

Experimental Molecular Properties

Property	Value	Reference
Melting Point	Not Available	Not Available
Boiling Point	Not Available	Not Available
Water Solubility	Not Available	Not Available
LogP	Not Available	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	1.7 g/L	ALOGPS
logP	0.25	ALOGPS
logP	-0.43	ChemAxon
logS	-2.5	ALOGPS
pKa (Strongest Acidic)	8.1	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	14	ChemAxon
Hydrogen Donor Count	8	ChemAxon
Polar Surface Area	225.06 Å²	ChemAxon
Rotatable Bond Count	7	ChemAxon
Refractivity	131.93 m³·mol⁻¹	ChemAxon
Polarizability	54.08 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	227.369	31661259
DarkChem	[M-H]-	221.922	31661259
DeepCCS	[M+H]+	222.209	30932474
DeepCCS	[M-H]-	219.813	30932474
DeepCCS	[M-2H]-	253.015	30932474
DeepCCS	[M+Na]+	228.121	30932474
AllCCS	[M+H]+	225.2	32859911
AllCCS	[M+H-H2O]+	223.7	32859911
AllCCS	[M+NH4]+	226.6	32859911
AllCCS	[M+Na]+	227.0	32859911
AllCCS	[M-H]-	220.2	32859911
AllCCS	[M+Na-2H]-	221.9	32859911
AllCCS	[M+HCOO]-	223.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C1O	5921.6	Standard polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C1O	4328.6	Standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(OC3=C2)C2=CC=C(O)C=C2)C(O)C1O	5194.3	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #1	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5042.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #2	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4970.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #3	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4985.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #4	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4986.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #5	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4998.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #6	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4975.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #7	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4992.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,isomer #8	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4986.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #1	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4915.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #10	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4882.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #11	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4885.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #12	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4870.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #13	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4857.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #14	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4863.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #15	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4876.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #16	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4864.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #17	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4870.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #18	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4862.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #19	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4889.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #2	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4937.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #20	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4881.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #21	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4888.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #22	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4877.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #23	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4889.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #24	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4896.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #25	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4883.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #26	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4884.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #27	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4873.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #28	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4878.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #3	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4936.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #4	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4949.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #5	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4922.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #6	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4946.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #7	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4934.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #8	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4864.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TMS,isomer #9	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4874.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #1	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4793.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #10	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4850.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #11	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4830.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #12	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4843.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #13	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4816.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #14	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4850.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #15	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4832.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #16	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4826.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #17	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4860.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #18	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4842.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #19	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4829.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #2	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4792.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #20	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4812.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #21	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4836.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #22	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4738.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #23	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4754.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #24	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4741.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #25	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4752.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #26	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4731.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #27	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4766.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #28	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4766.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #29	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4761.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #3	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4799.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #30	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4743.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #31	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4772.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #32	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4768.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #33	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4749.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #34	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4764.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #35	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4750.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #36	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4743.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #37	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4770.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #38	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4753.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #39	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4788.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #4	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4789.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #40	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4772.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #41	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4771.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #42	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4805.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #43	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4789.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #44	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4775.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #45	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4757.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #46	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4783.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #47	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4788.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #48	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4807.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #49	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4791.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #5	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4804.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #50	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4785.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #51	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4770.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #52	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4788.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #53	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4795.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #54	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4780.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #55	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4802.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #56	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4778.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #6	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4783.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #7	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4826.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #8	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4840.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,3TMS,isomer #9	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4807.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #1	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4653.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #10	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4656.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #11	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4689.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #12	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4667.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #13	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4659.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #14	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4640.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #15	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4677.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #16	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4719.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #17	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4681.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #18	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4749.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #19	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4728.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #2	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4675.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #20	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4702.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #21	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4766.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #22	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4747.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #23	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4713.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #24	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4688.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #25	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4752.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #26	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4717.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #27	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4764.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #28	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4746.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #29	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4711.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #3	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4650.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #30	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4689.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #31	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4736.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #32	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4728.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #33	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4704.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #34	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4750.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #35	CC(O[Si](C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4712.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #36	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4631.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #37	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4607.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #38	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4634.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #39	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4612.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #4	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4686.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #40	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4624.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #41	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4657.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #42	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4633.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #43	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4635.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #44	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4616.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #45	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4657.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #46	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4649.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #47	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4677.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #48	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4654.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #49	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4640.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #5	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4661.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #50	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4624.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #51	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4648.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #52	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4653.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #53	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4635.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #54	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4661.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #55	CC(O)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4643.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #56	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4665.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #57	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4696.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #58	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4677.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #59	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4669.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #6	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	4685.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #60	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4646.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #61	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4709.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #62	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4691.5	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #63	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4667.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #64	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4728.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #65	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4687.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #66	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4710.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #67	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4688.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #68	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4724.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #69	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4682.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #7	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O)C1O	4647.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #70	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O[Si](C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4701.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #8	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C)C1O	4677.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,4TMS,isomer #9	CC(O[Si](C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C	4656.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #1	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5264.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #2	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5195.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #3	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5205.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #4	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5235.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #5	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5245.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #6	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5204.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #7	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5234.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TBDMS,isomer #8	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5228.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #1	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5325.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #10	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5303.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #11	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5326.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #12	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5294.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #13	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5278.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #14	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5272.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #15	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5294.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #16	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5288.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #17	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5293.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #18	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5281.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #19	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5315.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #2	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5333.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #20	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5309.9	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #21	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5310.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #22	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5295.3	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #23	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5317.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #24	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5324.1	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #25	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5309.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #26	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5311.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #27	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5301.2	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #28	CC(O)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	5302.8	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #3	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5345.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #4	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5355.4	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #5	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O[Si](C)(C)C(C)(C)C)C=C4)OC3=C2)C(O)C1O	5334.6	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #6	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5360.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #7	CC(O[Si](C)(C)C(C)(C)C)C1OC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5345.7	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #8	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5279.0	Semi standard non polar	33892256
Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,2TBDMS,isomer #9	CC(O)C1OC(OC2=CC(O[Si](C)(C)C(C)(C)C)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C=C4)OC3=C2)C(O)C1O	5293.3	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 - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-05fs-9300140000-9a9febd6e8042c5861a5	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (1 TMS) - 70eV, Positive	splash10-01b9-7900014000-2a89f02798a81f2c600a	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS ("Kaempferol 3-arabinofuranoside 7-rhamnofuranoside,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_14) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside GC-MS (TMS_2_15) - 70eV, Positive	Not Available	2021-10-15	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 - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 10V, Positive-QTOF	splash10-014i-1120940000-ee9af5f3ffa2bb14a5a6	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 20V, Positive-QTOF	splash10-00kr-0290700000-4ff253fd8a658498904f	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 40V, Positive-QTOF	splash10-000i-4390200000-1a35c00a0e5d53c3c594	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 10V, Negative-QTOF	splash10-03dj-2105980000-340da087bf915dfa340b	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 20V, Negative-QTOF	splash10-00ls-0543920000-6954d9ddc37c5d62e4d8	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 40V, Negative-QTOF	splash10-001r-2392100000-eb17e0eda2219f66e6ff	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 10V, Negative-QTOF	splash10-03di-0000090000-1ddcbbabd04d8a1d8d41	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 20V, Negative-QTOF	splash10-03di-0030090000-d30ab537f560397de18b	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 40V, Negative-QTOF	splash10-001m-4391030000-09fc2db0cae6e6338622	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 10V, Positive-QTOF	splash10-014i-0000090000-2b44d7c7097dece6794d	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 20V, Positive-QTOF	splash10-014i-0000090000-13ffcb50b5c7ddcda668	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Kaempferol 3-arabinofuranoside 7-rhamnofuranoside 40V, Positive-QTOF	splash10-00kb-2090150000-07608fe8afa4daa20671	2021-09-24	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	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

FDB016673

KNApSAcK ID

C00058061

Chemspider ID

35014438

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

73715821

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 Kaempferol 3-arabinofuranoside 7-rhamnofuranoside (HMDB0037575)

MOL for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

3D MOL for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

3D SDF for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

3D-SDF for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

PDB for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

3D PDB for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

SMILES for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

INCHI for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

Structure for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

3D Structure for HMDB0037575 (Kaempferol 3-arabinofuranoside 7-rhamnofuranoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra