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Record Information

Version

5.0

Status

Detected but not Quantified

Creation Date

2012-09-11 22:36:15 UTC

Update Date

2022-09-22 17:44:07 UTC

HMDB ID

HMDB0037362

Secondary Accession Numbers

HMDB37362

Metabolite Identification

Common Name

Isoquercitrin

Description

Isoquercitrin, also known as isotrifoliin, belongs to the class of organic compounds known as flavonoid-3-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C3-position. Thus, isoquercitrin is considered to be a flavonoid. Isoquercitrin is an odorless tasting compound. Isoquercitrin is found, on average, in the highest concentration within a few different foods, such as black chokeberries (Photinia melanocarpa), teas (Camellia sinensis), and green tea and in a lower concentration in grape wine, pears (Pyrus communis), and rubus (blackberry, raspberry). Isoquercitrin has also been detected, but not quantified in, several different foods, such as bilberries (Vaccinium myrtillus), globe artichokes (Cynara scolymus), black-eyed peas (Vigna unguiculata ssp. unguiculata), common wheats (Triticum aestivum), and tortilla. This could make isoquercitrin a potential biomarker for the consumption of these foods. Isoquercitrin is a secondary metabolite. Secondary metabolites are metabolically or physiologically non-essential metabolites that may serve a role as defense or signalling molecules. In some cases they are simply molecules that arise from the incomplete metabolism of other secondary metabolites. Based on a literature review a significant number of articles have been published on Isoquercitrin.

Structure

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


  Mrv1652309272007312D          

 33 36  0  0  0  0            999 V2000
   33.3569  -23.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3569  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.6395  -23.8229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.9265  -23.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.0699  -24.6563    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   32.6437  -22.1686    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.9305  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -25.0627    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   34.0699  -23.8313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -25.8877    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   33.3527  -25.0627    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.0699  -26.2982    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   31.2132  -23.8271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3527  -25.8877    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   34.0741  -22.1728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.2132  -22.1728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.5001  -23.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.0741  -21.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -20.9456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.6395  -24.6481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.5001  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5045  -21.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -22.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -22.1811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -24.6481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -26.2940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.2132  -24.6522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.0741  -27.1233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7831  -20.1205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.6479  -26.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.2218  -20.9456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.7870  -22.1728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.6479  -27.1233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  9  1  1  0  0  0
  6  2  1  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10  8  1  0  0  0  0
 11  5  1  0  0  0  0
 12 14  1  0  0  0  0
 13  4  2  0  0  0  0
 14 11  1  0  0  0  0
 15  2  1  0  0  0  0
 16  7  2  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19 18  2  0  0  0  0
 20  3  2  0  0  0  0
 21 16  1  0  0  0  0
 22 19  1  0  0  0  0
 23 15  2  0  0  0  0
 24 23  1  0  0  0  0
  8 25  1  6  0  0  0
 10 26  1  1  0  0  0
 27 13  1  0  0  0  0
 12 28  1  6  0  0  0
 29 19  1  0  0  0  0
 14 30  1  1  0  0  0
 31 22  1  0  0  0  0
 32 21  1  0  0  0  0
 33 30  1  0  0  0  0
  4  7  1  0  0  0  0
 22 24  2  0  0  0  0
 12 10  1  0  0  0  0
 17 21  2  0  0  0  0
M  END

HMDB0037362
     RDKit          3D
Isoquercitrin
 53 56  0  0  0  0  0  0  0  0999 V2000
   -0.2726   -1.3741   -2.8599 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257   -1.3441   -1.8654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9334   -0.3255   -0.9074 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0374    0.6369   -1.1147 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3791    0.4698   -0.7027 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8346    1.3636    0.2413 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1733    1.3119    0.4792 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5427    2.2629    1.6305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8418    1.8696    2.7842 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0841    1.4965   -0.6870 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9897    0.4323   -0.7677 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2487    1.5831   -1.9367 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6589    2.8174   -2.1095 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2615    0.4474   -1.9281 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9418   -0.7601   -2.0154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7631   -0.2992    0.1743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7966    0.6784    1.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1777    1.8871    1.1421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1697    2.8150    2.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7988    2.5198    3.3508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8155    3.4173    4.4202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4364    1.2947    3.4684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0705    1.0299    4.6774 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4383    0.3886    2.4354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6602   -1.2868    0.2816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8071   -2.2607   -0.5561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7894   -3.2228   -0.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9525   -4.2589   -1.1964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9358   -5.2019   -0.9325 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1554   -4.3360   -2.2974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1679   -3.3724   -2.5449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4147   -3.5137   -3.6571 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9769   -2.3163   -1.6761 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4420   -0.5366   -0.2396 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    0.2878    0.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6215    2.0701    1.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3212    3.3042    1.3851 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1090    0.9603    3.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    2.4737   -0.6057 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9005    0.8034   -0.6101 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9586    1.3569   -2.7884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0386    2.7500   -2.8812 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6430    0.5562   -2.8364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2662   -1.4689   -1.7875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    2.2392    0.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6657    3.7807    2.0911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3698    4.3048    4.3714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5689    0.1761    4.8858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9296   -0.5579    2.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3960   -3.1180    0.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1377   -5.9927   -1.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2936   -5.1539   -2.9825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6986   -3.0852   -4.1210 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
  3 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 22 24  2  0
 16 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 31 32  1  0
 31 33  2  0
 33  2  1  0
 14  5  1  0
 24 17  1  0
 33 26  1  0
  5 34  1  1
  7 35  1  1
  8 36  1  0
  8 37  1  0
  9 38  1  0
 10 39  1  1
 11 40  1  0
 12 41  1  6
 13 42  1  0
 14 43  1  6
 15 44  1  0
 18 45  1  0
 19 46  1  0
 21 47  1  0
 23 48  1  0
 24 49  1  0
 27 50  1  0
 29 51  1  0
 30 52  1  0
 32 53  1  0
M  END


  Mrv1652309272007312D          

 33 36  0  0  0  0            999 V2000
   33.3569  -23.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3569  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.6395  -23.8229    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.9265  -23.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.0699  -24.6563    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   32.6437  -22.1686    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.9305  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -25.0627    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   34.0699  -23.8313    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -25.8877    0.0000 C   0  0  2  0  0  0  0  0  0  0  0  0
   33.3527  -25.0627    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.0699  -26.2982    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   31.2132  -23.8271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   33.3527  -25.8877    0.0000 C   0  0  1  0  0  0  0  0  0  0  0  0
   34.0741  -22.1728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   31.2132  -22.1728    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   30.5001  -23.4166    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.0741  -21.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -20.9456    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   32.6395  -24.6481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   30.5001  -22.5874    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5045  -21.3561    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   34.7873  -22.5957    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -22.1811    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -24.6481    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   35.5003  -26.2940    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   31.2132  -24.6522    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.0741  -27.1233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   34.7831  -20.1205    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.6479  -26.2982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   36.2218  -20.9456    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   29.7870  -22.1728    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   32.6479  -27.1233    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  3  1  1  0  0  0  0
  4  3  1  0  0  0  0
  5  9  1  1  0  0  0
  6  2  1  0  0  0  0
  7  6  1  0  0  0  0
  8  5  1  0  0  0  0
  9  1  1  0  0  0  0
 10  8  1  0  0  0  0
 11  5  1  0  0  0  0
 12 14  1  0  0  0  0
 13  4  2  0  0  0  0
 14 11  1  0  0  0  0
 15  2  1  0  0  0  0
 16  7  2  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19 18  2  0  0  0  0
 20  3  2  0  0  0  0
 21 16  1  0  0  0  0
 22 19  1  0  0  0  0
 23 15  2  0  0  0  0
 24 23  1  0  0  0  0
  8 25  1  6  0  0  0
 10 26  1  1  0  0  0
 27 13  1  0  0  0  0
 12 28  1  6  0  0  0
 29 19  1  0  0  0  0
 14 30  1  1  0  0  0
 31 22  1  0  0  0  0
 32 21  1  0  0  0  0
 33 30  1  0  0  0  0
  4  7  1  0  0  0  0
 22 24  2  0  0  0  0
 12 10  1  0  0  0  0
 17 21  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0037362

> <DATABASE_NAME>
hmdb

> <SMILES>
OC[C@H]1O[C@@H](OC2=C(OC3=CC(O)=CC(O)=C3C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O

> <INCHI_IDENTIFIER>
InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1

> <INCHI_KEY>
OVSQVDMCBVZWGM-QSOFNFLRSA-N

> <FORMULA>
C21H20O12

> <MOLECULAR_WEIGHT>
464.3763

> <EXACT_MASS>
464.095476104

> <JCHEM_ACCEPTOR_COUNT>
12

> <JCHEM_ATOM_COUNT>
53

> <JCHEM_AVERAGE_POLARIZABILITY>
43.56059300915922

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
8

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
1

> <JCHEM_IUPAC>
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

> <ALOGPS_LOGP>
0.47

> <JCHEM_LOGP>
-0.14483529600000053

> <ALOGPS_LOGS>
-2.38

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
4

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
7.87252087509293

> <JCHEM_PKA_STRONGEST_ACIDIC>
6.372405531686565

> <JCHEM_PKA_STRONGEST_BASIC>
-2.98109237118166

> <JCHEM_POLAR_SURFACE_AREA>
206.6

> <JCHEM_REFRACTIVITY>
109.2755

> <JCHEM_ROTATABLE_BOND_COUNT>
4

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
1.95e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
isoquercitin

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037362
     RDKit          3D
Isoquercitrin
 53 56  0  0  0  0  0  0  0  0999 V2000
   -0.2726   -1.3741   -2.8599 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257   -1.3441   -1.8654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9334   -0.3255   -0.9074 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0374    0.6369   -1.1147 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3791    0.4698   -0.7027 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8346    1.3636    0.2413 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1733    1.3119    0.4792 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5427    2.2629    1.6305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8418    1.8696    2.7842 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0841    1.4965   -0.6870 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9897    0.4323   -0.7677 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2487    1.5831   -1.9367 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6589    2.8174   -2.1095 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2615    0.4474   -1.9281 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9418   -0.7601   -2.0154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7631   -0.2992    0.1743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7966    0.6784    1.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1777    1.8871    1.1421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1697    2.8150    2.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7988    2.5198    3.3508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8155    3.4173    4.4202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4364    1.2947    3.4684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0705    1.0299    4.6774 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4383    0.3886    2.4354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6602   -1.2868    0.2816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8071   -2.2607   -0.5561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7894   -3.2228   -0.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9525   -4.2589   -1.1964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9358   -5.2019   -0.9325 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1554   -4.3360   -2.2974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1679   -3.3724   -2.5449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4147   -3.5137   -3.6571 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9769   -2.3163   -1.6761 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4420   -0.5366   -0.2396 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    0.2878    0.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6215    2.0701    1.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3212    3.3042    1.3851 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1090    0.9603    3.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    2.4737   -0.6057 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9005    0.8034   -0.6101 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9586    1.3569   -2.7884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0386    2.7500   -2.8812 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6430    0.5562   -2.8364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2662   -1.4689   -1.7875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    2.2392    0.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6657    3.7807    2.0911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3698    4.3048    4.3714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5689    0.1761    4.8858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9296   -0.5579    2.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3960   -3.1180    0.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1377   -5.9927   -1.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2936   -5.1539   -2.9825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6986   -3.0852   -4.1210 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
  3 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 22 24  2  0
 16 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 31 32  1  0
 31 33  2  0
 33  2  1  0
 14  5  1  0
 24 17  1  0
 33 26  1  0
  5 34  1  1
  7 35  1  1
  8 36  1  0
  8 37  1  0
  9 38  1  0
 10 39  1  1
 11 40  1  0
 12 41  1  6
 13 42  1  0
 14 43  1  6
 15 44  1  0
 18 45  1  0
 19 46  1  0
 21 47  1  0
 23 48  1  0
 24 49  1  0
 27 50  1  0
 29 51  1  0
 30 52  1  0
 32 53  1  0
M  END

HEADER    PROTEIN                                 27-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   27-SEP-20         0                                  
HETATM    1  C   UNK     0      62.266 -43.711   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      62.266 -42.163   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0      60.927 -44.469   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      59.596 -43.703   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0      63.597 -46.025   0.000  0.00  0.00           C+0
HETATM    6  O   UNK     0      60.935 -41.381   0.000  0.00  0.00           O+0
HETATM    7  C   UNK     0      59.604 -42.163   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      64.936 -46.784   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0      63.597 -44.485   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0      64.936 -48.324   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      62.258 -46.784   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      63.597 -49.090   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      58.265 -44.477   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      62.258 -48.324   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      63.605 -41.389   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      58.265 -41.389   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      56.934 -43.711   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      63.605 -39.865   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      64.936 -39.098   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      60.927 -46.010   0.000  0.00  0.00           O+0
HETATM   21  C   UNK     0      56.934 -42.163   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0      66.275 -39.865   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0      64.936 -42.179   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      66.267 -41.405   0.000  0.00  0.00           C+0
HETATM   25  O   UNK     0      66.267 -46.010   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0      66.267 -49.082   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      58.265 -46.017   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      63.605 -50.630   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      64.928 -37.558   0.000  0.00  0.00           O+0
HETATM   30  C   UNK     0      60.943 -49.090   0.000  0.00  0.00           C+0
HETATM   31  O   UNK     0      67.614 -39.098   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      55.602 -41.389   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0      60.943 -50.630   0.000  0.00  0.00           O+0
CONECT    1    2    3    9                                                  
CONECT    2    1    6   15                                                  
CONECT    3    1    4   20                                                  
CONECT    4    3   13    7                                                  
CONECT    5    9    8   11                                                  
CONECT    6    2    7                                                       
CONECT    7    6   16    4                                                  
CONECT    8    5   10   25                                                  
CONECT    9    5    1                                                       
CONECT   10    8   26   12                                                  
CONECT   11    5   14                                                       
CONECT   12   14   28   10                                                  
CONECT   13    4   17   27                                                  
CONECT   14   12   11   30                                                  
CONECT   15    2   18   23                                                  
CONECT   16    7   21                                                       
CONECT   17   13   21                                                       
CONECT   18   15   19                                                       
CONECT   19   18   22   29                                                  
CONECT   20    3                                                            
CONECT   21   16   32   17                                                  
CONECT   22   19   31   24                                                  
CONECT   23   15   24                                                       
CONECT   24   23   22                                                       
CONECT   25    8                                                            
CONECT   26   10                                                            
CONECT   27   13                                                            
CONECT   28   12                                                            
CONECT   29   19                                                            
CONECT   30   14   33                                                       
CONECT   31   22                                                            
CONECT   32   21                                                            
CONECT   33   30                                                            
MASTER        0    0    0    0    0    0    0    0   33    0   72    0
END

COMPND    HMDB0037362
HETATM    1  O1  UNL     1      -0.273  -1.374  -2.860  1.00  0.00           O  
HETATM    2  C1  UNL     1      -1.026  -1.344  -1.865  1.00  0.00           C  
HETATM    3  C2  UNL     1      -0.933  -0.326  -0.907  1.00  0.00           C  
HETATM    4  O2  UNL     1       0.037   0.637  -1.115  1.00  0.00           O  
HETATM    5  C3  UNL     1       1.379   0.470  -0.703  1.00  0.00           C  
HETATM    6  O3  UNL     1       1.835   1.364   0.241  1.00  0.00           O  
HETATM    7  C4  UNL     1       3.173   1.312   0.479  1.00  0.00           C  
HETATM    8  C5  UNL     1       3.543   2.263   1.631  1.00  0.00           C  
HETATM    9  O4  UNL     1       2.842   1.870   2.784  1.00  0.00           O  
HETATM   10  C6  UNL     1       4.084   1.497  -0.687  1.00  0.00           C  
HETATM   11  O5  UNL     1       4.990   0.432  -0.768  1.00  0.00           O  
HETATM   12  C7  UNL     1       3.249   1.583  -1.937  1.00  0.00           C  
HETATM   13  O6  UNL     1       2.659   2.817  -2.110  1.00  0.00           O  
HETATM   14  C8  UNL     1       2.262   0.447  -1.928  1.00  0.00           C  
HETATM   15  O7  UNL     1       2.942  -0.760  -2.015  1.00  0.00           O  
HETATM   16  C9  UNL     1      -1.763  -0.299   0.174  1.00  0.00           C  
HETATM   17  C10 UNL     1      -1.797   0.678   1.238  1.00  0.00           C  
HETATM   18  C11 UNL     1      -1.178   1.887   1.142  1.00  0.00           C  
HETATM   19  C12 UNL     1      -1.170   2.815   2.187  1.00  0.00           C  
HETATM   20  C13 UNL     1      -1.799   2.520   3.351  1.00  0.00           C  
HETATM   21  O8  UNL     1      -1.816   3.417   4.420  1.00  0.00           O  
HETATM   22  C14 UNL     1      -2.436   1.295   3.468  1.00  0.00           C  
HETATM   23  O9  UNL     1      -3.070   1.030   4.677  1.00  0.00           O  
HETATM   24  C15 UNL     1      -2.438   0.389   2.435  1.00  0.00           C  
HETATM   25  O10 UNL     1      -2.660  -1.287   0.282  1.00  0.00           O  
HETATM   26  C16 UNL     1      -2.807  -2.261  -0.556  1.00  0.00           C  
HETATM   27  C17 UNL     1      -3.789  -3.223  -0.313  1.00  0.00           C  
HETATM   28  C18 UNL     1      -3.953  -4.259  -1.196  1.00  0.00           C  
HETATM   29  O11 UNL     1      -4.936  -5.202  -0.933  1.00  0.00           O  
HETATM   30  C19 UNL     1      -3.155  -4.336  -2.297  1.00  0.00           C  
HETATM   31  C20 UNL     1      -2.168  -3.372  -2.545  1.00  0.00           C  
HETATM   32  O12 UNL     1      -1.415  -3.514  -3.657  1.00  0.00           O  
HETATM   33  C21 UNL     1      -1.977  -2.316  -1.676  1.00  0.00           C  
HETATM   34  H1  UNL     1       1.442  -0.537  -0.240  1.00  0.00           H  
HETATM   35  H2  UNL     1       3.377   0.288   0.915  1.00  0.00           H  
HETATM   36  H3  UNL     1       4.621   2.070   1.857  1.00  0.00           H  
HETATM   37  H4  UNL     1       3.321   3.304   1.385  1.00  0.00           H  
HETATM   38  H5  UNL     1       3.109   0.960   3.061  1.00  0.00           H  
HETATM   39  H6  UNL     1       4.620   2.474  -0.606  1.00  0.00           H  
HETATM   40  H7  UNL     1       5.900   0.803  -0.610  1.00  0.00           H  
HETATM   41  H8  UNL     1       3.959   1.357  -2.788  1.00  0.00           H  
HETATM   42  H9  UNL     1       2.039   2.750  -2.881  1.00  0.00           H  
HETATM   43  H10 UNL     1       1.643   0.556  -2.836  1.00  0.00           H  
HETATM   44  H11 UNL     1       2.266  -1.469  -1.787  1.00  0.00           H  
HETATM   45  H12 UNL     1      -0.674   2.239   0.255  1.00  0.00           H  
HETATM   46  H13 UNL     1      -0.666   3.781   2.091  1.00  0.00           H  
HETATM   47  H14 UNL     1      -1.370   4.305   4.371  1.00  0.00           H  
HETATM   48  H15 UNL     1      -3.569   0.176   4.886  1.00  0.00           H  
HETATM   49  H16 UNL     1      -2.930  -0.558   2.524  1.00  0.00           H  
HETATM   50  H17 UNL     1      -4.396  -3.118   0.573  1.00  0.00           H  
HETATM   51  H18 UNL     1      -5.138  -5.993  -1.508  1.00  0.00           H  
HETATM   52  H19 UNL     1      -3.294  -5.154  -2.982  1.00  0.00           H  
HETATM   53  H20 UNL     1      -0.699  -3.085  -4.121  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   33
CONECT    3    4   16   16
CONECT    4    5
CONECT    5    6   14   34
CONECT    6    7
CONECT    7    8   10   35
CONECT    8    9   36   37
CONECT    9   38
CONECT   10   11   12   39
CONECT   11   40
CONECT   12   13   14   41
CONECT   13   42
CONECT   14   15   43
CONECT   15   44
CONECT   16   17   25
CONECT   17   18   18   24
CONECT   18   19   45
CONECT   19   20   20   46
CONECT   20   21   22
CONECT   21   47
CONECT   22   23   24   24
CONECT   23   48
CONECT   24   49
CONECT   25   26
CONECT   26   27   27   33
CONECT   27   28   50
CONECT   28   29   30   30
CONECT   29   51
CONECT   30   31   52
CONECT   31   32   33   33
CONECT   32   53
END

HMDB0037362
     RDKit          3D
Isoquercitrin
 53 56  0  0  0  0  0  0  0  0999 V2000
   -0.2726   -1.3741   -2.8599 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0257   -1.3441   -1.8654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9334   -0.3255   -0.9074 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0374    0.6369   -1.1147 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.3791    0.4698   -0.7027 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8346    1.3636    0.2413 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.1733    1.3119    0.4792 C   0  0  2  0  0  0  0  0  0  0  0  0
    3.5427    2.2629    1.6305 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8418    1.8696    2.7842 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.0841    1.4965   -0.6870 C   0  0  1  0  0  0  0  0  0  0  0  0
    4.9897    0.4323   -0.7677 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.2487    1.5831   -1.9367 C   0  0  2  0  0  0  0  0  0  0  0  0
    2.6589    2.8174   -2.1095 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.2615    0.4474   -1.9281 C   0  0  1  0  0  0  0  0  0  0  0  0
    2.9418   -0.7601   -2.0154 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7631   -0.2992    0.1743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7966    0.6784    1.2376 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1777    1.8871    1.1421 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1697    2.8150    2.1871 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7988    2.5198    3.3508 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8155    3.4173    4.4202 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4364    1.2947    3.4684 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0705    1.0299    4.6774 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4383    0.3886    2.4354 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6602   -1.2868    0.2816 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8071   -2.2607   -0.5561 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7894   -3.2228   -0.3133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9525   -4.2589   -1.1964 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9358   -5.2019   -0.9325 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1554   -4.3360   -2.2974 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1679   -3.3724   -2.5449 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4147   -3.5137   -3.6571 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9769   -2.3163   -1.6761 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4420   -0.5366   -0.2396 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3772    0.2878    0.9150 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6215    2.0701    1.8568 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3212    3.3042    1.3851 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1090    0.9603    3.0610 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6200    2.4737   -0.6057 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9005    0.8034   -0.6101 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9586    1.3569   -2.7884 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0386    2.7500   -2.8812 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6430    0.5562   -2.8364 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2662   -1.4689   -1.7875 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    2.2392    0.2547 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6657    3.7807    2.0911 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3698    4.3048    4.3714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5689    0.1761    4.8858 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9296   -0.5579    2.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3960   -3.1180    0.5735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1377   -5.9927   -1.5079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2936   -5.1539   -2.9825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6986   -3.0852   -4.1210 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  7 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 12 14  1  0
 14 15  1  0
  3 16  2  0
 16 17  1  0
 17 18  2  0
 18 19  1  0
 19 20  2  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
 22 24  2  0
 16 25  1  0
 25 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 31 32  1  0
 31 33  2  0
 33  2  1  0
 14  5  1  0
 24 17  1  0
 33 26  1  0
  5 34  1  1
  7 35  1  1
  8 36  1  0
  8 37  1  0
  9 38  1  0
 10 39  1  1
 11 40  1  0
 12 41  1  6
 13 42  1  0
 14 43  1  6
 15 44  1  0
 18 45  1  0
 19 46  1  0
 21 47  1  0
 23 48  1  0
 24 49  1  0
 27 50  1  0
 29 51  1  0
 30 52  1  0
 32 53  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
2-(3,4-Dihidroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	ChEBI
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	ChEBI
Isoquercetin	ChEBI
Isotrifoliin	ChEBI
2-(3,4-Dihidroxyphenyl)-3-(b-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	Generator
2-(3,4-Dihidroxyphenyl)-3-(β-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	Generator
2-(3,4-Dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	Generator
2-(3,4-Dihydroxyphenyl)-3-(β-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	Generator
2-(3,4-Dihydroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one	MeSH
4H-1-Benzopyran-4-one, 2-(3,4-dihydroxyphenyl)-3-(beta-D-glucofuranosyloxy)-5,7-dihydroxy	MeSH
Flavone, 3,3',4',5,7-pentahydroxy-, 3-beta-D-glucofuranoside	MeSH
Isoquercitin	MeSH
Isoquercitroside	MeSH
Quercetin 3-(beta-D-glucofuranoside)	MeSH
Quercetin 3-O-beta-D-glucofuranoside	MeSH
Quercetin-3-O-beta-glucoside	MeSH
Quercetin-3-O-glucoside	MeSH
Quercetin-3-glucoside	MeSH
Trifoliin	MeSH
Trifoliin a	MeSH
2-(3,4-Dihydroxyphenyl)-3-(b-D-glucopyranosyloxy)-5,7-dihydroxy-4H-1-benzopyran-4-one, 9ci	HMDB
3,3',4',5,7-Pentahydroxyflavone 3-beta-glucoside	HMDB
3-Glucopyranosyloxy-3',4',5,7-tetrahydroxyflavone	HMDB
3-Glucosylquercetin	HMDB
Glucosyl 3-quercetin	HMDB
Hirsutrin	HMDB
Quercetin 3-beta-D-glucoside	HMDB
Quercetin 3-beta-glucoside	HMDB
Quercetin 3-beta-O-glucoside	HMDB
Quercetin 3-D-glucoside	HMDB
Quercetin 3-glucopyranoside	HMDB
Quercetin 3-glucoside	HMDB
Quercetin 3-monoglucoside	HMDB
Quercetin 3-O-glucopyranoside	HMDB
Quercetin 3-O-glucoside	HMDB
Quercetol 3-glucoside	HMDB
Quercetol 3-monoglucoside	HMDB
Isoquercitrin	ChEBI
Quercetin 3-O-b-D-glucopyranoside	Generator
Quercetin 3-O-β-D-glucopyranoside	Generator
3-O-beta-D-Glucopyranosylquercetin	PhytoBank
3-O-β-D-Glucopyranosylquercetin	PhytoBank
3-beta-D-Glucosylquercetin	PhytoBank
3-β-D-Glucosylquercetin	PhytoBank
3',4',5,7-Tetrahydroxyflavone-3-beta-D-glucopyranoside	PhytoBank
3',4',5,7-Tetrahydroxyflavone-3-β-D-glucopyranoside	PhytoBank
3’,4’,5,7-Tetrahydroxyflavone-3-β-D-glucopyranoside	PhytoBank
Contigoside B	PhytoBank
Glucosyl-3-quercetin	PhytoBank
Isoquercetrin	PhytoBank
Quercetin 3-O-beta-D-glucopyranoside	PhytoBank
Quercetin 3-O-beta-D-glucoside	PhytoBank
Quercetin 3-O-β-D-glucoside	PhytoBank
Quercetin 3-O-beta-glucoside	PhytoBank
Quercetin 3-O-β-glucoside	PhytoBank
Quercetin 3-mono-D-glucoside	PhytoBank
Quercetin 3-beta-D-glucopyranoside	PhytoBank
Quercetin 3-β-D-glucopyranoside	PhytoBank
Quercetin 3-β-D-glucoside	PhytoBank
Quercetin 3beta-O-glucoside	PhytoBank
Quercetin 3β-O-glucoside	PhytoBank
Quercetin 3beta-glucoside	PhytoBank
Quercetin 3β-glucoside	PhytoBank
Quercetin glucoside	PhytoBank
Quercetin-3-glucose	PhytoBank
Quercetin-3-beta-glucopyranoside	PhytoBank
Quercetin-3-β-glucopyranoside	PhytoBank

Chemical Formula

C₂₁H₂₀O₁₂

Average Molecular Weight

464.3763

Monoisotopic Molecular Weight

464.095476104

IUPAC Name

2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3-{[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4H-chromen-4-one

Traditional Name

isoquercitin

CAS Registry Number

482-35-9

SMILES

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

InChI Identifier

InChI=1S/C21H20O12/c22-6-13-15(27)17(29)18(30)21(32-13)33-20-16(28)14-11(26)4-8(23)5-12(14)31-19(20)7-1-2-9(24)10(25)3-7/h1-5,13,15,17-18,21-27,29-30H,6H2/t13-,15-,17+,18-,21+/m1/s1

InChI Key

OVSQVDMCBVZWGM-QSOFNFLRSA-N

Chemical Taxonomy

Description

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

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-3-O-glycosides

Alternative Parents

Substituents

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

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

beta-D-glucoside (CHEBI:68352 )
monosaccharide derivative (CHEBI:68352 )
tetrahydroxyflavone (CHEBI:68352 )
quercetin O-glucoside (CHEBI:68352 )
flavonols (C05623 )
Flavones and Flavonols (C05623 )

Ontology

Physiological effect

Organoleptic effect

Odor

odorless

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Blood (PMID: 16869998)

Cellular substructure

Extracellular (HMDB: HMDB0037362)
Cytoplasm (HMDB: HMDB0037362)

Herb and spice mixture

Curry powder (FooDB: FOOD00678)

Vegetable

Cabbage

Onion-family vegetable

Root vegetable

Shoot vegetable

Leaf vegetable

Common beet (FooDB: FOOD00025)
Endive (FooDB: FOOD00048)
Rocket salad (ssp.) (FooDB: FOOD00077)
Swamp cabbage (FooDB: FOOD00091)
Lettuce (FooDB: FOOD00095)
Garden cress (FooDB: FOOD00099)
Spinach (FooDB: FOOD00178)
Swiss chard (FooDB: FOOD00237)
Chicory leaves (FooDB: FOOD00250)
Garland chrysanthemum (FooDB: FOOD00333)
Corn salad (FooDB: FOOD00340)
Jute (FooDB: FOOD00389)
Lambsquarters (FooDB: FOOD00394)
Malabar spinach (FooDB: FOOD00404)
New Zealand spinach (FooDB: FOOD00415)
Yautia (FooDB: FOOD00510)
Ostrich fern (FooDB: FOOD00556)
Romaine lettuce (FooDB: FOOD00888)
Iceberg lettuce (FooDB: FOOD00973)
Pea shoots (FooDB: FOOD00975)
Yau choy (FooDB: FOOD00976)
Water spinach (FooDB: FOOD00977)

Fruit vegetable

Pepper (FooDB: FOOD00040)
Olive (FooDB: FOOD00121)
Avocado (FooDB: FOOD00130)
Garden tomato (FooDB: FOOD00171)
Cherry tomato (FooDB: FOOD00172)
Garden tomato (var.) (FooDB: FOOD00173)
Eggplant (FooDB: FOOD00174)
Pepper (C. baccatum) (FooDB: FOOD00231)
Pepper (C. chinense) (FooDB: FOOD00232)
Pepper (Capsicum) (FooDB: FOOD00233)
Groundcherry (FooDB: FOOD00371)
Pepper (C. frutescens) (FooDB: FOOD00428)
Mexican groundcherry (FooDB: FOOD00491)
Pepper (C. pubescens) (FooDB: FOOD00849)
Green bell pepper (FooDB: FOOD00877)
Yellow bell pepper (FooDB: FOOD00878)
Orange bell pepper (FooDB: FOOD00879)
Red bell pepper (FooDB: FOOD00880)
Italian sweet red pepper (FooDB: FOOD00881)
Jalapeno pepper (FooDB: FOOD00955)
Cubanelle pepper (FooDB: FOOD00971)

Tuber

Stalk vegetable

Other vegetable

Giant butterbur (FooDB: FOOD00314)
Carob (FooDB: FOOD00321)
Chinese water chestnut (FooDB: FOOD00332)
Horseradish tree (FooDB: FOOD00379)
Sacred lotus (FooDB: FOOD00402)
Nopal (FooDB: FOOD00416)
Okra (FooDB: FOOD00420)
Sesbania flower (FooDB: FOOD00469)
Agave (FooDB: FOOD00563)
Narrowleaf cattail (FooDB: FOOD00564)
Heart of palm (FooDB: FOOD00718)
Tree fern (FooDB: FOOD00797)

Mushroom

Castanospermum australe (FooDB: FOOD00893)
Gentiana lutea (FooDB: FOOD00894)
Juniperus communis (FooDB: FOOD00895)
Albizia gummifera (FooDB: FOOD00896)

Fruit

Tropical fruit

Citrus

Lime (FooDB: FOOD00053)
Lemon (FooDB: FOOD00054)
Pummelo (FooDB: FOOD00055)
Mandarin orange (Clementine, Tangerine) (FooDB: FOOD00056)
Sweet orange (FooDB: FOOD00057)
Grapefruit/Pummelo hybrid (FooDB: FOOD00255)
Grapefruit (FooDB: FOOD00256)
Persian lime (FooDB: FOOD00543)
Sour orange (FooDB: FOOD00918)
Mikan (FooDB: FOOD00932)
Clementine (FooDB: FOOD00959)

Pome

Berry

Black crowberry (FooDB: FOOD00075)
Strawberry (FooDB: FOOD00083)
Black huckleberry (FooDB: FOOD00084)
Sea-buckthornberry (FooDB: FOOD00087)
Mulberry (FooDB: FOOD00116)
Black mulberry (FooDB: FOOD00117)
Black chokeberry (FooDB: FOOD00136)
Blackcurrant (FooDB: FOOD00155)
Redcurrant (FooDB: FOOD00156)
Gooseberry (FooDB: FOOD00157)
Cloudberry (FooDB: FOOD00161)
Red raspberry (FooDB: FOOD00162)
Black raspberry (FooDB: FOOD00163)
Black elderberry (FooDB: FOOD00166)
Rowanberry (FooDB: FOOD00176)
Vaccinium (Blueberry, Cranberry, Huckleberry) (FooDB: FOOD00188)
Lowbush blueberry (FooDB: FOOD00189)
Sparkleberry (FooDB: FOOD00190)
Highbush blueberry (FooDB: FOOD00191)
American cranberry (FooDB: FOOD00192)
Bilberry (FooDB: FOOD00193)
Lingonberry (FooDB: FOOD00194)
Muscadine grape (FooDB: FOOD00203)
Common grape (FooDB: FOOD00204)
Arctic blackberry (FooDB: FOOD00207)
Bayberry (FooDB: FOOD00209)
Elliott's blueberry (FooDB: FOOD00210)
Canada blueberry (FooDB: FOOD00211)
Bog bilberry (FooDB: FOOD00212)
Buffalo currant (FooDB: FOOD00213)
European cranberry (FooDB: FOOD00217)
Deerberry (FooDB: FOOD00218)
Cascade huckleberry (FooDB: FOOD00220)
Oval-leaf huckleberry (FooDB: FOOD00221)
Evergreen huckleberry (FooDB: FOOD00222)
Red huckleberry (FooDB: FOOD00223)
Summer grape (FooDB: FOOD00227)
Fox grape (FooDB: FOOD00228)
Half-highbush blueberry (FooDB: FOOD00248)
Jostaberry (FooDB: FOOD00257)
Sweet rowanberry (FooDB: FOOD00265)
Skunk currant (FooDB: FOOD00267)
Squashberry (FooDB: FOOD00344)
Elderberry (FooDB: FOOD00358)
Grape (FooDB: FOOD00369)
Alaska blueberry (FooDB: FOOD00380)
Loganberry (FooDB: FOOD00400)
Ohelo berry (FooDB: FOOD00419)
Salmonberry (FooDB: FOOD00456)
Strawberry guava (FooDB: FOOD00482)
Boysenberry (FooDB: FOOD00542)
Chinese bayberry (FooDB: FOOD00852)
Saskatoon berry (FooDB: FOOD00884)
Nanking cherry (FooDB: FOOD00885)
Rabbiteye blueberry (FooDB: FOOD00898)
Blackberry (FooDB: FOOD00906)
Partridge berry (FooDB: FOOD00931)
Green grape (FooDB: FOOD00964)
Red grape (FooDB: FOOD00965)
Black plum (FooDB: FOOD00966)
Black raisin (FooDB: FOOD00968)
Chinese plum (FooDB: FOOD00978)
Green plum (FooDB: FOOD00979)
Wampee (FooDB: FOOD00980)
Goji (FooDB: FOOD00982)
Monk fruit (FooDB: FOOD00983)
Hawthorn (FooDB: FOOD00985)
Lantern fruit (FooDB: FOOD00986)
Cape gooseberry (FooDB: FOOD00988)
Rubus (Blackberry, Raspberry) (FooDB: FOOD00160)

Other fruit

Fig (FooDB: FOOD00081)
Date (FooDB: FOOD00135)
Jujube (FooDB: FOOD00388)

Drupe

Prunus (Cherry, Plum) (FooDB: FOOD00143)
Apricot (FooDB: FOOD00144)
Sweet cherry (FooDB: FOOD00145)
Sour cherry (FooDB: FOOD00146)
European plum (FooDB: FOOD00147)
Peach (FooDB: FOOD00149)
Nectarine (FooDB: FOOD00229)
Peach (var.) (FooDB: FOOD00230)
Common chokecherry (FooDB: FOOD00562)

Nut

Cashew nut (FooDB: FOOD00011)
Peanut (FooDB: FOOD00016)
Brazil nut (FooDB: FOOD00024)
Pecan nut (FooDB: FOOD00044)
Chestnut (FooDB: FOOD00045)
Common hazelnut (FooDB: FOOD00062)
Black walnut (FooDB: FOOD00093)
Common walnut (FooDB: FOOD00094)
Pine nut (FooDB: FOOD00138)
Pistachio (FooDB: FOOD00140)
Almond (FooDB: FOOD00148)
Macadamia nut (M. tetraphylla) (FooDB: FOOD00225)
Japanese walnut (FooDB: FOOD00240)
Acorn (FooDB: FOOD00282)
Beech nut (FooDB: FOOD00299)
Butternut (FooDB: FOOD00316)
Chinese chestnut (FooDB: FOOD00331)
European chestnut (FooDB: FOOD00363)
Hazelnut (FooDB: FOOD00376)
Hickory nut (FooDB: FOOD00377)
Japanese chestnut (FooDB: FOOD00385)
Pili nut (FooDB: FOOD00432)
Colorado pinyon (FooDB: FOOD00433)
Macadamia nut (FooDB: FOOD00525)
Walnut (FooDB: FOOD00608)

Cereal and cereal product

Cereal

Cereal product

Pasta (FooDB: FOOD00273)
Bulgur (FooDB: FOOD00741)
Semolina (FooDB: FOOD00745)
Flour (FooDB: FOOD00799)

Dough

Sourdough (FooDB: FOOD00275)

Leavened bread

Flat bread

Other bread

Potato bread (FooDB: FOOD00811)

Sweet bread

Raisin bread (FooDB: FOOD00817)

Pulse

Pea

Lentil

Lentils (FooDB: FOOD00098)

Other pulse

Lupine (FooDB: FOOD00104)
White lupine (FooDB: FOOD00403)

Bean

Green lentil (FooDB: FOOD00970)

Gourd

Watermelon (FooDB: FOOD00052)
Muskmelon (FooDB: FOOD00064)
Cucumber (FooDB: FOOD00065)
Cucurbita (FooDB: FOOD00066)
Bitter gourd (FooDB: FOOD00115)
Winter squash (FooDB: FOOD00283)
Butternut squash (FooDB: FOOD00317)
Calabash (FooDB: FOOD00318)
Chayote (FooDB: FOOD00325)
Towel gourd (FooDB: FOOD00492)
Wax gourd (FooDB: FOOD00499)
Tinda (FooDB: FOOD00559)
Horned melon (FooDB: FOOD00761)
Sunburst squash (pattypan squash) (FooDB: FOOD00874)
Green zucchini (FooDB: FOOD00875)
Yellow zucchini (FooDB: FOOD00876)
Japanese pumpkin (FooDB: FOOD00886)
Acorn squash (FooDB: FOOD00972)
Cantaloupe melon (FooDB: FOOD00984)

Coffee and coffee product

Coffee

Arabica coffee (FooDB: FOOD00059)
Robusta coffee (FooDB: FOOD00060)

Soy

Soy bean (FooDB: FOOD00085)

Soy product

Soy sauce (FooDB: FOOD00694)
Miso (FooDB: FOOD00695)
Tofu (FooDB: FOOD00696)
Soy milk (FooDB: FOOD00736)
Soy cream (FooDB: FOOD00784)

Tea

Herbal tea

Hibiscus tea (FooDB: FOOD00723)
Greenthread tea (FooDB: FOOD00820)

Baking good

Wrapper

Wonton wrapper (FooDB: FOOD00818)

Seasoning

Vinegar (FooDB: FOOD00628)

Dish

Other dish

Taco shell (FooDB: FOOD00991)
Tostada shell (FooDB: FOOD00992)

Beverage

Other beverage

Fruit juice (FooDB: FOOD00763)

Fermented beverage

Grape wine (FooDB: FOOD00612)
Berry wine (FooDB: FOOD00613)

Alcoholic beverage

Alcoholic beverages (FooDB: FOOD00854)

Cocoa and cocoa product

Cocoa

Cocoa bean (FooDB: FOOD00182)

Process

Naturally occurring process

Biological process

Biochemical pathway

Metabolic pathway

Flavone and Flavonol Biosynthesis (PathBank: SMP0012025)

EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (HMDB: HMDB0037362)
angiotensin converting enzyme inhibitor (HMDB: HMDB0037362)
EC 1.1.1.21 (aldehyde reductase) inhibitor (HMDB: HMDB0037362)
antielastase (HMDB: HMDB0037362)
TNF-alpha inhibitor (HMDB: HMDB0037362)
topoisomerase-II inhibitor (HMDB: HMDB0037362)

Indirect biological role

antioxidant (HMDB: HMDB0037362)

Industrial application

Manufacturing industry

Material processing agent

Coloring agent

Fluorescent agent

antiviral agent (HMDB: HMDB0037362)
diuretic (HMDB: HMDB0037362)

Agriculture

Pesticide

Insecticide

pesticide (HMDB: HMDB0037362)

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	238 - 242 °C	Not Available
Boiling Point	872.60 °C. @ 760.00 mm Hg (est)	The Good Scents Company Information System
Water Solubility	27820 mg/L @ 25 °C (est)	The Good Scents Company Information System
LogP	1.750 (est)	The Good Scents Company Information System

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	1.95 g/L	ALOGPS
logP	0.47	ALOGPS
logP	-0.14	ChemAxon
logS	-2.4	ALOGPS
pKa (Strongest Acidic)	6.37	ChemAxon
pKa (Strongest Basic)	-3	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	12	ChemAxon
Hydrogen Donor Count	8	ChemAxon
Polar Surface Area	206.6 Å²	ChemAxon
Rotatable Bond Count	4	ChemAxon
Refractivity	109.28 m³·mol⁻¹	ChemAxon
Polarizability	43.56 Å³	ChemAxon
Number of Rings	4	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	Yes	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DeepCCS	[M+H]+	195.699	30932474
DeepCCS	[M-H]-	193.303	30932474
DeepCCS	[M-2H]-	226.563	30932474
DeepCCS	[M+Na]+	201.609	30932474
AllCCS	[M+H]+	204.9	32859911
AllCCS	[M+H-H2O]+	202.6	32859911
AllCCS	[M+NH4]+	207.1	32859911
AllCCS	[M+Na]+	207.7	32859911
AllCCS	[M-H]-	201.9	32859911
AllCCS	[M+Na-2H]-	202.3	32859911
AllCCS	[M+HCOO]-	202.9	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Isoquercitrin	OC[C@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	6061.4	Standard polar	33892256
Isoquercitrin	OC[C@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4270.3	Standard non polar	33892256
Isoquercitrin	OC[C@H]1O[C@@H](OC2=C(OC3=C(C(O)=CC(O)=C3)C2=O)C2=CC=C(O)C(O)=C2)[C@H](O)[C@@H](O)[C@@H]1O	4395.1	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Isoquercitrin,1TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4293.2	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #2	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4344.2	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #3	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4398.4	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #4	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4352.5	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #5	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4342.3	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #6	C[Si](C)(C)O[C@H]1[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@@H](O)[C@@H]1O	4343.5	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #7	C[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O	4335.8	Semi standard non polar	33892256
Isoquercitrin,1TMS,isomer #8	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O	4314.3	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4184.1	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #10	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	4216.3	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #11	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4210.8	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #12	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4224.7	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #13	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4223.9	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #14	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4226.4	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #15	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4240.8	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #16	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4251.5	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #17	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4232.1	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #18	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4220.7	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #19	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4194.1	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4171.5	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #20	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4213.2	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #21	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4218.8	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #22	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4210.7	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #23	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4180.0	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #24	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4193.7	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #25	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4200.3	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #26	C[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@@H]1CO	4199.4	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #27	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O	4216.4	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #28	C[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C	4193.1	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4220.0	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4193.7	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4217.3	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4211.6	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4222.3	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #8	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4244.2	Semi standard non polar	33892256
Isoquercitrin,2TMS,isomer #9	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4229.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4087.0	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4078.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4103.4	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4107.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4148.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4131.7	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4152.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4129.0	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4114.9	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4134.2	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4149.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4067.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4183.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4153.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4118.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #23	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4118.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #24	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4128.9	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #25	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4118.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #26	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4116.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #27	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4069.4	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #28	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4074.7	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #29	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	4084.4	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4062.2	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #30	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4096.9	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #31	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	4062.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #32	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	4066.2	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #33	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	4076.0	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #34	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4115.6	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #35	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4116.4	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #36	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4131.7	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #37	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4134.0	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #38	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4137.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #39	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4071.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4106.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #40	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4069.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #41	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4154.7	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #42	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4072.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #43	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4067.9	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #44	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4090.2	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #45	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4084.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #46	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4105.8	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #47	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4083.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #48	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4091.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4099.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4087.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #50	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4107.9	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #51	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4110.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #52	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4119.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #53	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4080.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #54	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4085.3	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #55	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4102.2	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #56	C[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O[Si](C)(C)C	4130.5	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4113.7	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4061.6	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4054.1	Semi standard non polar	33892256
Isoquercitrin,3TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4096.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4019.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4000.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3966.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4008.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4053.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4084.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4057.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4003.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4009.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3974.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4018.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	3997.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3992.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3957.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4000.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4044.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4072.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #25	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4046.1	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #26	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4064.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #27	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4025.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #28	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4068.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #29	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4113.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4057.5	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #30	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4142.5	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4113.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4089.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #33	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4120.1	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #34	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4090.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #35	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4153.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #36	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4046.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #37	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4049.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #38	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4025.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #39	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4024.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	4024.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #40	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4058.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #41	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4028.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #42	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4029.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #43	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4023.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4021.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #45	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4057.1	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #46	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	3985.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #47	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	3983.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #48	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4009.3	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	3996.1	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4064.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #50	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	3992.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #51	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4013.1	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #52	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	3978.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #53	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	3975.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #54	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	3988.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4084.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #56	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4116.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #57	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4001.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #58	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3998.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #59	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4003.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4008.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #60	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3996.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #61	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4032.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #62	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4013.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #63	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4007.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #64	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4010.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #65	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4033.0	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #66	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4052.7	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #67	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4045.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #68	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4049.4	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #69	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4058.2	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4013.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #70	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4047.8	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3978.9	Semi standard non polar	33892256
Isoquercitrin,4TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4024.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	3992.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4029.8	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3979.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3968.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3988.8	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3984.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3995.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3989.9	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3966.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3975.1	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3970.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	4002.5	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4045.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3976.5	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #22	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3964.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #23	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3983.9	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #24	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3977.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #25	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3984.1	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #26	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3980.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #27	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3957.6	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #28	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3960.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #29	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3960.4	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3974.9	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #30	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4035.4	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #31	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4006.1	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #32	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4015.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #33	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4005.4	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #34	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4113.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #35	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4089.6	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #36	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4024.0	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #37	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4006.4	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #38	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4006.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #39	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4001.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	4013.9	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #40	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3998.1	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #41	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4017.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #42	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	3999.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #43	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3998.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #44	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4009.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #45	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4009.6	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #46	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O	3980.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #47	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	3982.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #48	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	3978.8	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #49	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	3983.3	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3982.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #50	C[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)=CC=C1O	3970.4	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #51	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4004.8	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #52	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	3995.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #53	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4004.2	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #54	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	3999.9	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #55	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4007.7	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #56	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4039.6	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3956.6	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3991.5	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	4028.5	Semi standard non polar	33892256
Isoquercitrin,5TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	4038.5	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #1	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O	3984.4	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #10	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4043.3	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #11	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3975.5	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #12	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3978.5	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #13	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3985.5	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #14	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4012.3	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #15	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3998.3	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #16	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3979.8	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #17	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3982.7	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #18	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3990.8	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #19	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4006.8	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #2	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O	3972.0	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #20	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3988.4	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #21	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4018.2	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #22	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC2=C1	4004.6	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #23	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC2=C1	4009.1	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #24	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4010.7	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #25	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4000.8	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #26	C[Si](C)(C)OC1=CC(O[Si](C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4004.0	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #27	C[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C	4000.6	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #28	C[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C)[C@H](O[Si](C)(C)C)[C@H]3O[Si](C)(C)C)=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC2=C1	4018.4	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #3	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C	3987.0	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #4	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3998.0	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #5	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3998.7	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #6	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O[Si](C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	4002.0	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #7	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O[Si](C)(C)C)[C@@H]1O	3983.5	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #8	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C	3982.8	Semi standard non polar	33892256
Isoquercitrin,6TMS,isomer #9	C[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C	3985.5	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4572.5	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4598.8	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4619.9	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4612.0	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4586.3	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@@H](O)[C@@H]1O	4581.2	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O	4583.6	Semi standard non polar	33892256
Isoquercitrin,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O	4564.6	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4664.6	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O	4665.4	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4679.9	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4682.5	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4687.8	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4692.8	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4698.3	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4706.2	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4710.9	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4683.9	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4664.2	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4639.4	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4672.5	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4677.7	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	4664.1	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4642.5	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4649.6	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4654.6	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)O[C@H]1[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@@H]1CO	4678.7	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O	4697.3	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](CO)O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C	4679.4	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4682.2	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4662.8	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4679.4	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4662.1	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4677.2	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4696.3	Semi standard non polar	33892256
Isoquercitrin,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O	4693.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4735.9	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4696.2	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4715.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4751.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4785.3	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4752.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4778.4	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4761.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4728.9	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4754.8	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4780.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4773.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4797.2	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O[Si](C)(C)C(C)(C)C	4782.4	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4774.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4772.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4772.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4869.3	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4830.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O	4774.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O	4784.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O	4776.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4754.6	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	4783.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O	4747.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O	4755.6	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(O)C=C3O2)=CC=C1O	4748.8	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O)=C(C1=CC=C(O)C(O)=C1)O2	4743.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4741.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(O)=CC2=C1C(=O)C(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1O[Si](C)(C)C(C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	4759.8	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4764.1	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4767.4	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4787.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4744.6	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4760.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C(O)=C3)OC2=C1	4785.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4796.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4767.2	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC2=C1	4792.5	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4764.8	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)OC1=CC(O)=C2C(=O)C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC2=C1	4800.2	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4730.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4731.3	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	4750.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]1O	4718.4	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O	4751.9	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	4747.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	4755.3	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4711.6	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](O)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4709.6	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(O)C=C3O2)=CC=C1O	4731.3	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)O[C@@H]1[C@@H](O[Si](C)(C)C(C)(C)C)[C@H](OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)O[C@H](CO)[C@H]1O[Si](C)(C)C(C)(C)C	4764.7	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O[Si](C)(C)C(C)(C)C	4740.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4746.0	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)[C@H](O)[C@@H](O)[C@@H]1O	4726.8	Semi standard non polar	33892256
Isoquercitrin,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC[C@H]1O[C@@H](OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(O)=CC(O)=C3C2=O)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H](O)[C@@H]1O	4720.7	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 - Isoquercitrin GC-MS (Non-derivatized) - 70eV, Positive	splash10-0uea-8903800000-499ac85a438f6221151e	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Isoquercitrin GC-MS (3 TMS) - 70eV, Positive	splash10-014r-3620009000-aa92fb234d45c04fb4a1	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Isoquercitrin GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Isoquercitrin GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-qTof , Positive-QTOF	splash10-0udi-0009000000-5b33a5f16f6e2b064a26	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-03di-0000900000-04fd0a90f823358ed680	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-03di-0001900000-a884073b5df03fc34d44	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0udi-0009200000-abf468a3d736431e673c	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0udi-0019000000-6c4a0f0151f89b993af7	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0uk9-0096000000-2a8faa231ffe4833d3e5	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0w29-0179700000-4feff1360b5c3797e945	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-03di-0003900002-fb997b013c890e4beb25	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0udi-0059000000-f059e0c8ce382613a8af	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-03di-0000900000-2ca67c601c5cd16acf0e	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , negative-QTOF	splash10-0udi-0079400000-53c1ad9f9a822003ead8	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin , negative-QTOF	splash10-0w29-0029400000-e04499260d75d9c87784	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009200000-57d1b2e15f55ae809385	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009000000-0ac33fff6c0d20867fa4	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009000000-6b8e2bdefa584c75e6c6	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009000000-dff25d3afe49ed2abe87	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009000000-29733c57848cecc33e70	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0009000000-06624a60d6ef7aa134bb	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Isoquercitrin LC-ESI-QTOF , positive-QTOF	splash10-0udi-0109000000-cfa8aaba41883dcf51e5	2017-09-14	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 10V, Positive-QTOF	splash10-0uxr-0238900000-84d67141521459a118c0	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 20V, Positive-QTOF	splash10-0udi-0269100000-855726a927e888161d78	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 40V, Positive-QTOF	splash10-0f79-2962000000-bc39b0d9e5586054d85f	2016-08-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 10V, Negative-QTOF	splash10-0ik9-1306900000-12c0a6f0c9db05e8c9bd	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 20V, Negative-QTOF	splash10-0udi-2439200000-fc56cb8d8bcb486e96a6	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Isoquercitrin 40V, Negative-QTOF	splash10-0zfr-6963000000-3bde95e6420d1d4a73e4	2016-08-03	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-25	Wishart Lab	View Spectrum

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Blood
Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 293	16869998	details
Blood	Expected but not Quantified	Not Quantified	Not Available	Not Available	Consuming polyphenols described by Phenol-Explorer entry 293	15595664	details

Abnormal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Urine	Detected but not Quantified	Not Quantified	Not Specified	Not Specified	Cancer patients undergoing total body irradiation	31424920	details

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

DB12665

Phenol Explorer Compound ID

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Isoquercetin

METLIN ID

Not Available

PubChem Compound

5280804

PDB ID

Not Available

ChEBI ID

68352

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

rw1699081

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Amado NG, Cerqueira DM, Menezes FS, da Silva JF, Neto VM, Abreu JG: Isoquercitrin isolated from Hyptis fasciculata reduces glioblastoma cell proliferation and changes beta-catenin cellular localization. Anticancer Drugs. 2009 Aug;20(7):543-52. doi: 10.1097/CAD.0b013e32832d1149. [PubMed:19491660 ]
(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Isoquercitrin (HMDB0037362)

MOL for HMDB0037362 (Isoquercitrin)

3D MOL for HMDB0037362 (Isoquercitrin)

3D SDF for HMDB0037362 (Isoquercitrin)

3D-SDF for HMDB0037362 (Isoquercitrin)

PDB for HMDB0037362 (Isoquercitrin)

3D PDB for HMDB0037362 (Isoquercitrin)

SMILES for HMDB0037362 (Isoquercitrin)

INCHI for HMDB0037362 (Isoquercitrin)

Structure for HMDB0037362 (Isoquercitrin)

3D Structure for HMDB0037362 (Isoquercitrin)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra