Jump To Section:

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

Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 22:36:24 UTC

Update Date

2022-03-07 02:55:17 UTC

HMDB ID

HMDB0037364

Secondary Accession Numbers

HMDB37364

Metabolite Identification

Common Name

Quercetin 3-glucoside 7-xyloside

Description

Quercetin 3-glucoside 7-xyloside belongs to the class of organic compounds known as flavonoid-7-o-glycosides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to carbohydrate moiety at the C7-position. Quercetin 3-glucoside 7-xyloside has been detected, but not quantified in, fruits. This could make quercetin 3-glucoside 7-xyloside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Quercetin 3-glucoside 7-xyloside.

Structure

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

  Mrv0541 05061309452D          

 42 46  0  0  0  0            999 V2000
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  8  1  1  0  0  0  0
  8  3  2  0  0  0  0
  9  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 11 10  2  0  0  0  0
 12  4  1  0  0  0  0
 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
 16 12  2  0  0  0  0
 16 14  1  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
 21 17  1  0  0  0  0
 22 20  1  0  0  0  0
 23  8  1  0  0  0  0
 24 19  1  0  0  0  0
 24 23  2  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
 27  6  1  0  0  0  0
 28 10  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
 31 13  1  0  0  0  0
 32 17  1  0  0  0  0
 33 18  1  0  0  0  0
 34 19  2  0  0  0  0
 35 20  1  0  0  0  0
 36 21  1  0  0  0  0
 37 22  1  0  0  0  0
 38  7  1  0  0  0  0
 38 25  1  0  0  0  0
 39  9  1  0  0  0  0
 39 25  1  0  0  0  0
 40 14  1  0  0  0  0
 40 23  1  0  0  0  0
 41 15  1  0  0  0  0
 41 26  1  0  0  0  0
 42 24  1  0  0  0  0
 42 26  1  0  0  0  0
M  END

HMDB0037364
     RDKit          3D
Quercetin 3-glucoside 7-xyloside
 70 74  0  0  0  0  0  0  0  0999 V2000
   -1.5565   -0.2739    2.0105 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9360   -0.6219    0.9768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7034   -0.9890   -0.1486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0554   -0.9294   -0.0251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7959    0.2800   -0.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3297    0.6141    1.1219 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6083    1.9617    1.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1423    2.3780    2.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4180    3.7443    2.4539 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6775    2.3189    0.1040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5553    3.6918   -0.1644 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5976    1.5701   -1.1623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8935    1.4337   -1.6883 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9328    0.2081   -1.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8704   -0.7350   -0.5972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0312   -1.3672   -1.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6437   -1.7907   -2.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9504   -2.1417   -2.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5330   -2.5117   -3.8341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7389   -2.5167   -4.9425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2703   -2.8773   -6.1686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4146   -2.1704   -4.8720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6375   -2.1838   -5.9981 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8756   -1.8108   -3.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3173   -1.3766   -1.2596 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0528   -1.0439   -0.2466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4529   -1.0857   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2448   -0.7359    0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5971   -0.7959    0.5504 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5924   -0.4940    1.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4819   -1.5618    1.4903 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4232   -1.4634    2.4978 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7977   -0.0651    2.8527 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1636    0.3452    4.0344 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5158    0.9540    1.8016 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6509    1.1857    0.9876 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3634    0.6892    0.9077 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4890    1.7918    0.8615 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6254   -0.3494    1.8643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234   -0.2923    2.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6826    0.0995    3.1790 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4469   -0.6478    0.9320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0824    1.1003   -0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7006    2.5372    0.8585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4583    2.1401    3.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1420    1.8684    2.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6436    4.1004    3.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6855    2.2096    0.6012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6628    4.0417    0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0348    2.1674   -1.9413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4213    2.2087   -1.4458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6665   -0.0559   -2.1358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4966   -1.2246    0.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5988   -2.1745   -1.7732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5710   -2.7884   -3.9221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7039   -2.8886   -7.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3365   -1.9306   -5.9515 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1870   -1.5337   -3.6153 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8658   -1.4082   -1.3081 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2264   -0.2092    2.4794 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2941   -2.0788    2.1998 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9896   -1.9480    3.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8857   -0.0414    3.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7730    0.5851    4.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3506    1.9589    2.2907 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9116    0.2720    0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7182    0.4205   -0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3618    2.0851   -0.0588 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2143   -0.0683    2.7195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1998    0.2200    3.5244 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
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 28 39  2  0
 39 40  1  0
 40 41  1  0
 40 42  2  0
 42  2  1  0
 14  5  1  0
 24 17  1  0
 42 26  1  0
 37 30  1  0
  5 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
 10 48  1  0
 11 49  1  0
 12 50  1  0
 13 51  1  0
 14 52  1  0
 15 53  1  0
 18 54  1  0
 19 55  1  0
 21 56  1  0
 23 57  1  0
 24 58  1  0
 27 59  1  0
 30 60  1  0
 32 61  1  0
 32 62  1  0
 33 63  1  0
 34 64  1  0
 35 65  1  0
 36 66  1  0
 37 67  1  0
 38 68  1  0
 39 69  1  0
 41 70  1  0
M  END

  Mrv0541 05061309452D          

 42 46  0  0  0  0            999 V2000
    2.8579    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7145   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    2.0625    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.1250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -1.6500    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -3.7125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1434    1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5724   -2.8875    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -0.4125    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -1.2375    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.8250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -2.4750    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0013   -0.4125    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    3.3000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -4.9500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -4.1250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8579    0.8250    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2868   -2.4750    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7145    1.2375    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4289    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1434   -2.8875    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8579   -1.6500    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  1  2  0  0  0  0
  8  1  1  0  0  0  0
  8  3  2  0  0  0  0
  9  4  2  0  0  0  0
  9  5  1  0  0  0  0
 10  2  1  0  0  0  0
 11  3  1  0  0  0  0
 11 10  2  0  0  0  0
 12  4  1  0  0  0  0
 13  7  1  0  0  0  0
 14  5  2  0  0  0  0
 15  6  1  0  0  0  0
 16 12  2  0  0  0  0
 16 14  1  0  0  0  0
 17 13  1  0  0  0  0
 18 15  1  0  0  0  0
 19 16  1  0  0  0  0
 20 18  1  0  0  0  0
 21 17  1  0  0  0  0
 22 20  1  0  0  0  0
 23  8  1  0  0  0  0
 24 19  1  0  0  0  0
 24 23  2  0  0  0  0
 25 21  1  0  0  0  0
 26 22  1  0  0  0  0
 27  6  1  0  0  0  0
 28 10  1  0  0  0  0
 29 11  1  0  0  0  0
 30 12  1  0  0  0  0
 31 13  1  0  0  0  0
 32 17  1  0  0  0  0
 33 18  1  0  0  0  0
 34 19  2  0  0  0  0
 35 20  1  0  0  0  0
 36 21  1  0  0  0  0
 37 22  1  0  0  0  0
 38  7  1  0  0  0  0
 38 25  1  0  0  0  0
 39  9  1  0  0  0  0
 39 25  1  0  0  0  0
 40 14  1  0  0  0  0
 40 23  1  0  0  0  0
 41 15  1  0  0  0  0
 41 26  1  0  0  0  0
 42 24  1  0  0  0  0
 42 26  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0037364

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2=C(OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C26H28O16/c27-6-15-18(33)20(35)22(37)26(41-15)42-24-19(34)16-12(30)4-9(39-25-21(36)17(32)13(31)7-38-25)5-14(16)40-23(24)8-1-2-10(28)11(29)3-8/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2

> <INCHI_KEY>
PSTSYYSBVQVSOG-UHFFFAOYSA-N

> <FORMULA>
C26H28O16

> <MOLECULAR_WEIGHT>
596.4909

> <EXACT_MASS>
596.137734848

> <JCHEM_ACCEPTOR_COUNT>
16

> <JCHEM_AVERAGE_POLARIZABILITY>
56.37158452767795

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

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

> <ALOGPS_LOGP>
-0.58

> <JCHEM_LOGP>
-1.782568447333333

> <ALOGPS_LOGS>
-2.21

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
8.746793859257517

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.107107690669936

> <JCHEM_PKA_STRONGEST_BASIC>
-3.6483953952505512

> <JCHEM_POLAR_SURFACE_AREA>
265.52

> <JCHEM_REFRACTIVITY>
135.45739999999992

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.65e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
2-(3,4-dihydroxyphenyl)-5-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]chromen-4-one

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0037364
     RDKit          3D
Quercetin 3-glucoside 7-xyloside
 70 74  0  0  0  0  0  0  0  0999 V2000
   -1.5565   -0.2739    2.0105 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9360   -0.6219    0.9768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7034   -0.9890   -0.1486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0554   -0.9294   -0.0251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7959    0.2800   -0.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3297    0.6141    1.1219 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6083    1.9617    1.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1423    2.3780    2.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4180    3.7443    2.4539 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6775    2.3189    0.1040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5553    3.6918   -0.1644 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5976    1.5701   -1.1623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8935    1.4337   -1.6883 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9328    0.2081   -1.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8704   -0.7350   -0.5972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0312   -1.3672   -1.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6437   -1.7907   -2.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9504   -2.1417   -2.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5330   -2.5117   -3.8341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7389   -2.5167   -4.9425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2703   -2.8773   -6.1686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4146   -2.1704   -4.8720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6375   -2.1838   -5.9981 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8756   -1.8108   -3.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3173   -1.3766   -1.2596 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0528   -1.0439   -0.2466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4529   -1.0857   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2448   -0.7359    0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5971   -0.7959    0.5504 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5924   -0.4940    1.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4819   -1.5618    1.4903 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4232   -1.4634    2.4978 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7977   -0.0651    2.8527 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1636    0.3452    4.0344 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5158    0.9540    1.8016 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6509    1.1857    0.9876 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3634    0.6892    0.9077 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4890    1.7918    0.8615 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6254   -0.3494    1.8643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234   -0.2923    2.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6826    0.0995    3.1790 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4469   -0.6478    0.9320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0824    1.1003   -0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7006    2.5372    0.8585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4583    2.1401    3.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1420    1.8684    2.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6436    4.1004    3.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6855    2.2096    0.6012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6628    4.0417    0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0348    2.1674   -1.9413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4213    2.2087   -1.4458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6665   -0.0559   -2.1358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4966   -1.2246    0.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5988   -2.1745   -1.7732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5710   -2.7884   -3.9221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7039   -2.8886   -7.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3365   -1.9306   -5.9515 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1870   -1.5337   -3.6153 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8658   -1.4082   -1.3081 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2264   -0.2092    2.4794 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2941   -2.0788    2.1998 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9896   -1.9480    3.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8857   -0.0414    3.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7730    0.5851    4.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3506    1.9589    2.2907 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9116    0.2720    0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7182    0.4205   -0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3618    2.0851   -0.0588 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2143   -0.0683    2.7195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1998    0.2200    3.5244 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
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 28 39  2  0
 39 40  1  0
 40 41  1  0
 40 42  2  0
 42  2  1  0
 14  5  1  0
 24 17  1  0
 42 26  1  0
 37 30  1  0
  5 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
 10 48  1  0
 11 49  1  0
 12 50  1  0
 13 51  1  0
 14 52  1  0
 15 53  1  0
 18 54  1  0
 19 55  1  0
 21 56  1  0
 23 57  1  0
 24 58  1  0
 27 59  1  0
 30 60  1  0
 32 61  1  0
 32 62  1  0
 33 63  1  0
 34 64  1  0
 35 65  1  0
 36 66  1  0
 37 67  1  0
 38 68  1  0
 39 69  1  0
 41 70  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0       5.335   1.540   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       6.668   2.310   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       6.668  -0.770   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0      -1.334  -2.310   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.000   0.000   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       2.667  -7.700   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -1.334   3.850   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       5.335   0.000   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0      -1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       8.002   1.540   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0       8.002   0.000   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0       0.000  -3.080   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.667   4.620   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       1.334  -0.770   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       4.001  -6.930   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       1.334  -2.310   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -4.001   3.850   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0       5.335  -7.700   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0       2.667  -3.080   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0       6.668  -6.930   0.000  0.00  0.00           C+0
HETATM   21  C   UNK     0      -4.001   2.310   0.000  0.00  0.00           C+0
HETATM   22  C   UNK     0       6.668  -5.390   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       4.001  -0.770   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       4.001  -2.310   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -2.667   1.540   0.000  0.00  0.00           C+0
HETATM   26  C   UNK     0       5.335  -4.620   0.000  0.00  0.00           C+0
HETATM   27  O   UNK     0       2.667  -9.240   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0       9.336   2.310   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0       9.336  -0.770   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0       0.000  -4.620   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0      -2.667   6.160   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      -5.335   4.620   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0       5.335  -9.240   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0       2.667  -4.620   0.000  0.00  0.00           O+0
HETATM   35  O   UNK     0       8.002  -7.700   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      -5.335   1.540   0.000  0.00  0.00           O+0
HETATM   37  O   UNK     0       8.002  -4.620   0.000  0.00  0.00           O+0
HETATM   38  O   UNK     0      -1.334   2.310   0.000  0.00  0.00           O+0
HETATM   39  O   UNK     0      -2.667   0.000   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       2.667   0.000   0.000  0.00  0.00           O+0
HETATM   41  O   UNK     0       4.001  -5.390   0.000  0.00  0.00           O+0
HETATM   42  O   UNK     0       5.335  -3.080   0.000  0.00  0.00           O+0
CONECT    1    2    8                                                       
CONECT    2    1   10                                                       
CONECT    3    8   11                                                       
CONECT    4    9   12                                                       
CONECT    5    9   14                                                       
CONECT    6   15   27                                                       
CONECT    7   13   38                                                       
CONECT    8    1    3   23                                                  
CONECT    9    4    5   39                                                  
CONECT   10    2   11   28                                                  
CONECT   11    3   10   29                                                  
CONECT   12    4   16   30                                                  
CONECT   13    7   17   31                                                  
CONECT   14    5   16   40                                                  
CONECT   15    6   18   41                                                  
CONECT   16   12   14   19                                                  
CONECT   17   13   21   32                                                  
CONECT   18   15   20   33                                                  
CONECT   19   16   24   34                                                  
CONECT   20   18   22   35                                                  
CONECT   21   17   25   36                                                  
CONECT   22   20   26   37                                                  
CONECT   23    8   24   40                                                  
CONECT   24   19   23   42                                                  
CONECT   25   21   38   39                                                  
CONECT   26   22   41   42                                                  
CONECT   27    6                                                            
CONECT   28   10                                                            
CONECT   29   11                                                            
CONECT   30   12                                                            
CONECT   31   13                                                            
CONECT   32   17                                                            
CONECT   33   18                                                            
CONECT   34   19                                                            
CONECT   35   20                                                            
CONECT   36   21                                                            
CONECT   37   22                                                            
CONECT   38    7   25                                                       
CONECT   39    9   25                                                       
CONECT   40   14   23                                                       
CONECT   41   15   26                                                       
CONECT   42   24   26                                                       
MASTER        0    0    0    0    0    0    0    0   42    0   92    0
END

COMPND    HMDB0037364
HETATM    1  O1  UNL     1      -1.556  -0.274   2.010  1.00  0.00           O  
HETATM    2  C1  UNL     1      -0.936  -0.622   0.977  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.703  -0.989  -0.149  1.00  0.00           C  
HETATM    4  O2  UNL     1      -3.055  -0.929  -0.025  1.00  0.00           O  
HETATM    5  C3  UNL     1      -3.796   0.280  -0.142  1.00  0.00           C  
HETATM    6  O3  UNL     1      -4.330   0.614   1.122  1.00  0.00           O  
HETATM    7  C4  UNL     1      -4.608   1.962   1.106  1.00  0.00           C  
HETATM    8  C5  UNL     1      -5.142   2.378   2.476  1.00  0.00           C  
HETATM    9  O4  UNL     1      -5.418   3.744   2.454  1.00  0.00           O  
HETATM   10  C6  UNL     1      -5.678   2.319   0.104  1.00  0.00           C  
HETATM   11  O5  UNL     1      -5.555   3.692  -0.164  1.00  0.00           O  
HETATM   12  C7  UNL     1      -5.598   1.570  -1.162  1.00  0.00           C  
HETATM   13  O6  UNL     1      -6.893   1.434  -1.688  1.00  0.00           O  
HETATM   14  C8  UNL     1      -4.933   0.208  -1.087  1.00  0.00           C  
HETATM   15  O7  UNL     1      -5.870  -0.735  -0.597  1.00  0.00           O  
HETATM   16  C9  UNL     1      -1.031  -1.367  -1.257  1.00  0.00           C  
HETATM   17  C10 UNL     1      -1.644  -1.791  -2.508  1.00  0.00           C  
HETATM   18  C11 UNL     1      -2.950  -2.142  -2.622  1.00  0.00           C  
HETATM   19  C12 UNL     1      -3.533  -2.512  -3.834  1.00  0.00           C  
HETATM   20  C13 UNL     1      -2.739  -2.517  -4.943  1.00  0.00           C  
HETATM   21  O8  UNL     1      -3.270  -2.877  -6.169  1.00  0.00           O  
HETATM   22  C14 UNL     1      -1.415  -2.170  -4.872  1.00  0.00           C  
HETATM   23  O9  UNL     1      -0.638  -2.184  -5.998  1.00  0.00           O  
HETATM   24  C15 UNL     1      -0.876  -1.811  -3.662  1.00  0.00           C  
HETATM   25  O10 UNL     1       0.317  -1.377  -1.260  1.00  0.00           O  
HETATM   26  C16 UNL     1       1.053  -1.044  -0.247  1.00  0.00           C  
HETATM   27  C17 UNL     1       2.453  -1.086  -0.349  1.00  0.00           C  
HETATM   28  C18 UNL     1       3.245  -0.736   0.714  1.00  0.00           C  
HETATM   29  O11 UNL     1       4.597  -0.796   0.550  1.00  0.00           O  
HETATM   30  C19 UNL     1       5.592  -0.494   1.486  1.00  0.00           C  
HETATM   31  O12 UNL     1       6.482  -1.562   1.490  1.00  0.00           O  
HETATM   32  C20 UNL     1       7.423  -1.463   2.498  1.00  0.00           C  
HETATM   33  C21 UNL     1       7.798  -0.065   2.853  1.00  0.00           C  
HETATM   34  O13 UNL     1       7.164   0.345   4.034  1.00  0.00           O  
HETATM   35  C22 UNL     1       7.516   0.954   1.802  1.00  0.00           C  
HETATM   36  O14 UNL     1       8.651   1.186   0.988  1.00  0.00           O  
HETATM   37  C23 UNL     1       6.363   0.689   0.908  1.00  0.00           C  
HETATM   38  O15 UNL     1       5.489   1.792   0.861  1.00  0.00           O  
HETATM   39  C24 UNL     1       2.625  -0.349   1.864  1.00  0.00           C  
HETATM   40  C25 UNL     1       1.223  -0.292   2.012  1.00  0.00           C  
HETATM   41  O16 UNL     1       0.683   0.100   3.179  1.00  0.00           O  
HETATM   42  C26 UNL     1       0.447  -0.648   0.932  1.00  0.00           C  
HETATM   43  H1  UNL     1      -3.082   1.100  -0.376  1.00  0.00           H  
HETATM   44  H2  UNL     1      -3.701   2.537   0.858  1.00  0.00           H  
HETATM   45  H3  UNL     1      -4.458   2.140   3.289  1.00  0.00           H  
HETATM   46  H4  UNL     1      -6.142   1.868   2.594  1.00  0.00           H  
HETATM   47  H5  UNL     1      -5.644   4.100   3.343  1.00  0.00           H  
HETATM   48  H6  UNL     1      -6.685   2.210   0.601  1.00  0.00           H  
HETATM   49  H7  UNL     1      -4.663   4.042   0.019  1.00  0.00           H  
HETATM   50  H8  UNL     1      -5.035   2.167  -1.941  1.00  0.00           H  
HETATM   51  H9  UNL     1      -7.421   2.209  -1.446  1.00  0.00           H  
HETATM   52  H10 UNL     1      -4.667  -0.056  -2.136  1.00  0.00           H  
HETATM   53  H11 UNL     1      -5.497  -1.225   0.174  1.00  0.00           H  
HETATM   54  H12 UNL     1      -3.599  -2.174  -1.773  1.00  0.00           H  
HETATM   55  H13 UNL     1      -4.571  -2.788  -3.922  1.00  0.00           H  
HETATM   56  H14 UNL     1      -2.704  -2.889  -7.001  1.00  0.00           H  
HETATM   57  H15 UNL     1       0.336  -1.931  -5.952  1.00  0.00           H  
HETATM   58  H16 UNL     1       0.187  -1.534  -3.615  1.00  0.00           H  
HETATM   59  H17 UNL     1       2.866  -1.408  -1.308  1.00  0.00           H  
HETATM   60  H18 UNL     1       5.226  -0.209   2.479  1.00  0.00           H  
HETATM   61  H19 UNL     1       8.294  -2.079   2.200  1.00  0.00           H  
HETATM   62  H20 UNL     1       6.990  -1.948   3.399  1.00  0.00           H  
HETATM   63  H21 UNL     1       8.886  -0.041   3.070  1.00  0.00           H  
HETATM   64  H22 UNL     1       7.773   0.585   4.750  1.00  0.00           H  
HETATM   65  H23 UNL     1       7.351   1.959   2.291  1.00  0.00           H  
HETATM   66  H24 UNL     1       8.912   0.272   0.650  1.00  0.00           H  
HETATM   67  H25 UNL     1       6.718   0.421  -0.119  1.00  0.00           H  
HETATM   68  H26 UNL     1       5.362   2.085  -0.059  1.00  0.00           H  
HETATM   69  H27 UNL     1       3.214  -0.068   2.720  1.00  0.00           H  
HETATM   70  H28 UNL     1      -0.200   0.220   3.524  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   42
CONECT    3    4   16   16
CONECT    4    5
CONECT    5    6   14   43
CONECT    6    7
CONECT    7    8   10   44
CONECT    8    9   45   46
CONECT    9   47
CONECT   10   11   12   48
CONECT   11   49
CONECT   12   13   14   50
CONECT   13   51
CONECT   14   15   52
CONECT   15   53
CONECT   16   17   25
CONECT   17   18   18   24
CONECT   18   19   54
CONECT   19   20   20   55
CONECT   20   21   22
CONECT   21   56
CONECT   22   23   24   24
CONECT   23   57
CONECT   24   58
CONECT   25   26
CONECT   26   27   27   42
CONECT   27   28   59
CONECT   28   29   39   39
CONECT   29   30
CONECT   30   31   37   60
CONECT   31   32
CONECT   32   33   61   62
CONECT   33   34   35   63
CONECT   34   64
CONECT   35   36   37   65
CONECT   36   66
CONECT   37   38   67
CONECT   38   68
CONECT   39   40   69
CONECT   40   41   42   42
CONECT   41   70
END

HMDB0037364
     RDKit          3D
Quercetin 3-glucoside 7-xyloside
 70 74  0  0  0  0  0  0  0  0999 V2000
   -1.5565   -0.2739    2.0105 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9360   -0.6219    0.9768 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7034   -0.9890   -0.1486 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0554   -0.9294   -0.0251 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7959    0.2800   -0.1418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3297    0.6141    1.1219 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6083    1.9617    1.1057 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1423    2.3780    2.4761 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4180    3.7443    2.4539 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6775    2.3189    0.1040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5553    3.6918   -0.1644 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5976    1.5701   -1.1623 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8935    1.4337   -1.6883 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9328    0.2081   -1.0868 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8704   -0.7350   -0.5972 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0312   -1.3672   -1.2573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6437   -1.7907   -2.5080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9504   -2.1417   -2.6218 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5330   -2.5117   -3.8341 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7389   -2.5167   -4.9425 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2703   -2.8773   -6.1686 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4146   -2.1704   -4.8720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6375   -2.1838   -5.9981 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8756   -1.8108   -3.6624 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3173   -1.3766   -1.2596 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0528   -1.0439   -0.2466 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4529   -1.0857   -0.3487 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2448   -0.7359    0.7143 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5971   -0.7959    0.5504 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.5924   -0.4940    1.4862 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4819   -1.5618    1.4903 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4232   -1.4634    2.4978 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7977   -0.0651    2.8527 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1636    0.3452    4.0344 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.5158    0.9540    1.8016 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6509    1.1857    0.9876 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.3634    0.6892    0.9077 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4890    1.7918    0.8615 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.6254   -0.3494    1.8643 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2234   -0.2923    2.0123 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6826    0.0995    3.1790 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4469   -0.6478    0.9320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0824    1.1003   -0.3760 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7006    2.5372    0.8585 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4583    2.1401    3.2894 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1420    1.8684    2.5943 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6436    4.1004    3.3427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6855    2.2096    0.6012 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6628    4.0417    0.0190 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0348    2.1674   -1.9413 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4213    2.2087   -1.4458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6665   -0.0559   -2.1358 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4966   -1.2246    0.1740 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5988   -2.1745   -1.7732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5710   -2.7884   -3.9221 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7039   -2.8886   -7.0012 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3365   -1.9306   -5.9515 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1870   -1.5337   -3.6153 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8658   -1.4082   -1.3081 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2264   -0.2092    2.4794 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2941   -2.0788    2.1998 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9896   -1.9480    3.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8857   -0.0414    3.0697 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7730    0.5851    4.7496 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3506    1.9589    2.2907 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9116    0.2720    0.6498 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7182    0.4205   -0.1186 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3618    2.0851   -0.0588 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2143   -0.0683    2.7195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1998    0.2200    3.5244 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
 29 30  1  0
 30 31  1  0
 31 32  1  0
 32 33  1  0
 33 34  1  0
 33 35  1  0
 35 36  1  0
 35 37  1  0
 37 38  1  0
 28 39  2  0
 39 40  1  0
 40 41  1  0
 40 42  2  0
 42  2  1  0
 14  5  1  0
 24 17  1  0
 42 26  1  0
 37 30  1  0
  5 43  1  0
  7 44  1  0
  8 45  1  0
  8 46  1  0
  9 47  1  0
 10 48  1  0
 11 49  1  0
 12 50  1  0
 13 51  1  0
 14 52  1  0
 15 53  1  0
 18 54  1  0
 19 55  1  0
 21 56  1  0
 23 57  1  0
 24 58  1  0
 27 59  1  0
 30 60  1  0
 32 61  1  0
 32 62  1  0
 33 63  1  0
 34 64  1  0
 35 65  1  0
 36 66  1  0
 37 67  1  0
 38 68  1  0
 39 69  1  0
 41 70  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Quercetin-3-glucoside 7-xyloside	HMDB

Chemical Formula

C₂₆H₂₈O₁₆

Average Molecular Weight

596.4909

Monoisotopic Molecular Weight

596.137734848

IUPAC Name

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

Traditional Name

2-(3,4-dihydroxyphenyl)-5-hydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-7-[(3,4,5-trihydroxyoxan-2-yl)oxy]chromen-4-one

CAS Registry Number

79592-61-3

SMILES

OCC1OC(OC2=C(OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O

InChI Identifier

InChI=1S/C26H28O16/c27-6-15-18(33)20(35)22(37)26(41-15)42-24-19(34)16-12(30)4-9(39-25-21(36)17(32)13(31)7-38-25)5-14(16)40-23(24)8-1-2-10(28)11(29)3-8/h1-5,13,15,17-18,20-22,25-33,35-37H,6-7H2

InChI Key

PSTSYYSBVQVSOG-UHFFFAOYSA-N

Chemical Taxonomy

Description

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

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-7-O-glycosides

Alternative Parents

Substituents

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

Molecular Framework

Aromatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0037364)
Cytoplasm (HMDB: HMDB0037364)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0037364)

Source

Exogenous

Exogenous (HMDB: HMDB0037364)

Food

Food (HMDB: HMDB0037364)

Fruit

Fruits (FooDB: FOOD00871)

Endogenous

Plant

Plant (HMDB: HMDB0037364)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0037364)

Physical Properties

State

Not Available

Experimental Molecular Properties

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

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	3.65 g/L	ALOGPS
logP	-0.58	ALOGPS
logP	-1.8	ChemAxon
logS	-2.2	ALOGPS
pKa (Strongest Acidic)	8.11	ChemAxon
pKa (Strongest Basic)	-3.6	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	16	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	265.52 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	135.46 m³·mol⁻¹	ChemAxon
Polarizability	56.37 Å³	ChemAxon
Number of Rings	5	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	234.419	31661259
DarkChem	[M-H]-	225.395	31661259
DeepCCS	[M+H]+	221.928	30932474
DeepCCS	[M-H]-	219.599	30932474
DeepCCS	[M-2H]-	252.839	30932474
DeepCCS	[M+Na]+	227.804	30932474
AllCCS	[M+H]+	228.4	32859911
AllCCS	[M+H-H2O]+	227.1	32859911
AllCCS	[M+NH4]+	229.6	32859911
AllCCS	[M+Na]+	230.0	32859911
AllCCS	[M-H]-	224.2	32859911
AllCCS	[M+Na-2H]-	226.2	32859911
AllCCS	[M+HCOO]-	228.4	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Quercetin 3-glucoside 7-xyloside	OCC1OC(OC2=C(OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O	5089.0	Standard polar	33892256
Quercetin 3-glucoside 7-xyloside	OCC1OC(OC2=C(OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O	5196.1	Standard non polar	33892256
Quercetin 3-glucoside 7-xyloside	OCC1OC(OC2=C(OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C2=CC(O)=C(O)C=C2)C(O)C(O)C1O	5562.9	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5462.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #10	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C1O	5493.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #2	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5509.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #3	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5491.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #4	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5500.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #5	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5495.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #6	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5536.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #7	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5545.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #8	C[Si](C)(C)OC1C(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)OC(CO)C(O)C1O	5505.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TMS,isomer #9	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C1O	5488.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5394.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #10	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5396.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #11	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5397.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #12	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5383.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #13	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5407.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #14	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5410.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #15	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5396.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #16	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5424.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #17	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5419.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #18	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5366.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #19	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5381.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5381.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #20	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5362.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #21	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5391.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #22	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5371.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #23	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5353.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #24	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O[Si](C)(C)C	5410.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #25	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5394.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #26	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C1O	5399.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #27	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5386.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #28	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5412.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #29	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5408.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5387.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #30	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5393.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #31	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5385.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #32	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5368.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #33	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5388.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #34	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5366.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #35	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5395.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #36	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5383.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #37	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5350.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #38	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5391.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #39	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5388.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5375.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #40	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5397.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #41	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5369.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #42	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5405.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #43	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C1O	5399.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #44	C[Si](C)(C)OC1C(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)OC(CO)C(O)C1O[Si](C)(C)C	5420.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #45	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C1O[Si](C)(C)C	5397.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5393.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5385.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5397.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5377.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5388.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5239.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5175.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #100	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5271.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #101	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5229.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #102	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5179.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #103	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5230.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #104	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5240.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #105	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5202.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #106	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5150.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #107	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5205.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #108	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5245.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #109	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5255.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5228.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #110	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5268.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #111	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5205.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #112	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5219.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #113	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5258.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #114	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5234.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #115	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5215.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #116	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5266.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #117	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5229.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #118	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5241.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #119	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5258.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5182.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #120	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5299.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5235.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5182.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5226.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5270.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5287.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5244.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5279.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5242.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5250.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5275.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5259.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5208.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5250.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5219.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5243.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5247.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5281.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5250.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5200.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5276.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5261.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5223.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5253.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5282.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5295.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5267.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #37	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5261.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #38	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5272.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #39	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5227.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5249.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #40	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5202.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #41	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5264.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #42	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5224.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #43	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5263.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #44	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5257.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #45	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5266.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #46	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5251.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #47	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5233.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #48	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5299.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #49	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5276.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5208.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #50	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5285.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #51	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5210.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #52	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5185.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #53	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5267.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #54	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5248.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #55	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5257.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #56	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5235.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #57	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5297.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #58	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5274.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #59	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5243.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5258.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #60	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5265.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #61	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5266.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #62	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5223.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #63	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5247.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #64	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5353.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #65	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5255.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #66	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5170.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #67	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5142.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #68	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5224.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #69	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5181.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5208.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #70	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5226.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #71	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5228.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #72	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5236.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #73	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5214.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #74	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5187.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #75	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C1O	5264.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #76	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5257.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #77	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5168.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #78	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5140.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #79	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C1O	5238.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5251.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #80	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5216.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #81	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5190.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #82	C[Si](C)(C)OC1C(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)OC(CO)C(O)C1O	5266.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #83	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5242.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #84	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5221.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #85	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5222.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #86	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5234.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #87	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5209.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #88	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5265.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #89	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5222.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5218.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #90	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5264.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #91	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5259.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #92	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5239.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #93	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C1O	5265.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #94	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5260.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #95	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5292.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #96	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5218.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #97	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5191.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #98	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5265.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,3TMS,isomer #99	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5244.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5081.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5036.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #100	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5035.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #101	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	4974.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #102	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5035.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #103	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5094.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #104	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5107.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #105	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5107.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #106	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5155.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #107	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5071.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #108	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5053.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #109	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5159.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5110.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #110	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5122.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #111	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5085.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #112	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5065.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #113	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5172.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #114	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5139.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #115	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5077.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #116	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5107.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #117	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5106.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #118	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5058.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #119	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5091.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5048.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #120	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5188.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #121	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5081.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #122	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5063.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #123	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O	5175.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #124	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C	5138.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #125	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5027.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #126	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5056.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #127	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5054.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #128	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5007.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #129	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5038.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5089.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #130	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5161.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #131	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5084.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #132	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5120.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #133	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5117.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #134	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5066.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #135	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5105.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #136	C[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5195.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #137	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5135.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #138	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5094.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #139	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5120.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5070.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #140	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5119.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #141	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5048.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #142	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5028.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #143	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5115.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #144	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5070.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #145	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5118.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #146	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5002.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #147	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	4946.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #148	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5003.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #149	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5011.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	4973.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #150	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	4977.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #151	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	4923.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #152	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	4978.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #153	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5053.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #154	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5066.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #155	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5071.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #156	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5122.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #157	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5024.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #158	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5005.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #159	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O[Si](C)(C)C	5125.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5061.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #160	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5037.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #161	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5016.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #162	C[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C1O	5139.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #163	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5086.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #164	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5059.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #165	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5069.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #166	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5040.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #167	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5020.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #168	C[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O[Si](C)(C)C	5140.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #169	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5038.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	4998.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #170	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5003.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #171	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5019.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #172	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O	5094.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #173	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O[Si](C)(C)C	5073.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #174	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5078.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #175	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5102.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #176	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5070.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #177	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5004.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #178	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5077.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #179	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5085.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5039.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #180	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5044.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #181	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	4978.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #182	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5053.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #183	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5111.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #184	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5121.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #185	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5122.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #186	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5085.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #187	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5099.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #188	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5125.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #189	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5068.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5043.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #190	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5081.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #191	C[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5162.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #192	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5099.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #193	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5082.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #194	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5073.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #195	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O[Si](C)(C)C	5136.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #196	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5046.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #197	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5057.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #198	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5077.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #199	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5058.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5028.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5124.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #200	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5017.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #201	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5082.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #202	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5025.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #203	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5036.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #204	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5036.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #205	C[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5130.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #206	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5086.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #207	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5085.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #208	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5100.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #209	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5101.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5062.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #210	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5104.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5104.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5073.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5013.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5051.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5097.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5122.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5085.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5047.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5093.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5077.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5012.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5091.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5025.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5068.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5052.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	4947.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5038.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	4971.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5014.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5048.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5020.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5108.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5042.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5085.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5049.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	4987.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5027.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5080.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5105.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5070.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5112.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5175.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5093.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5159.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5115.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5145.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5114.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5184.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5146.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #58	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5168.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5127.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5052.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5073.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5109.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5165.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #63	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5187.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #64	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5157.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O	5091.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5157.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5115.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5141.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #69	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5089.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5090.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #70	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5026.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #71	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5067.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #72	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5127.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #73	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5155.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #74	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5117.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O	5131.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #76	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O	5088.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #77	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C	5114.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #78	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5169.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #79	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5186.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5065.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #80	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5157.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #81	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5126.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #82	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5148.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #83	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C)=C3C2=O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5112.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #84	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5203.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #85	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5158.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #86	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)C=C1O	5037.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #87	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=C3O2)=CC=C1O	5016.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #88	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5108.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #89	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5057.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5094.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #90	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5113.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #91	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)C=C1O	5061.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #92	C[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=C3O2)=CC=C1O	5040.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #93	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5133.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #94	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5087.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #95	C[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5139.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #96	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5060.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #97	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	4998.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #98	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O	5059.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,4TMS,isomer #99	C[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C)C=C(OC4OCC(O[Si](C)(C)C)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C	5075.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5676.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C1O	5735.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5743.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5738.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5742.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5684.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5714.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5731.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)OC(CO)C(O)C1O	5740.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C1O	5726.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5765.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5779.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5787.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5767.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O	5785.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C(C)(C)C)C(O)C4O)C=C3O2)C=C1O	5788.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O[Si](C)(C)C(C)(C)C)C(O)C4O)C=C3O2)=CC=C1O	5762.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O[Si](C)(C)C(C)(C)C)C1O	5805.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C(O)C1O[Si](C)(C)C(C)(C)C	5789.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5754.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5758.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5736.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5736.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O	5755.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C(C)(C)C)C4O)C=C3O2)C=C1O	5763.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O[Si](C)(C)C(C)(C)C)C4O)C=C3O2)=CC=C1O	5733.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1C(O)COC(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)C1O[Si](C)(C)C(C)(C)C	5779.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5760.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)C(O)C1O	5765.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5745.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1C(OC2=CC(O)=C3C(=O)C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)=C(C4=CC=C(O)C(O)=C4)OC3=C2)OCC(O)C1O	5770.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C(C)(C)C)C=C3O2)C=C1O	5769.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O[Si](C)(C)C(C)(C)C)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5773.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O[Si](C)(C)C(C)(C)C)C=C3O2)=CC=C1O	5741.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5779.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5752.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5764.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)=C(C1=CC=C(O)C(O)=C1)O2	5747.5	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=CC(OC2OCC(O)C(O)C2O)=CC2=C1C(=O)C(OC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)=C(C1=CC=C(O)C(O)=C1)O2	5762.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5746.4	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5730.8	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1=CC(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)=CC=C1O	5743.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O[Si](C)(C)C(C)(C)C	5762.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O[Si](C)(C)C(C)(C)C)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O	5748.6	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5773.3	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5760.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1=CC=C(C2=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C(=O)C3=C(O)C=C(OC4OCC(O)C(O)C4O)C=C3O2)C=C1O	5770.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C(C)(C)C)C1O	5776.2	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1C(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	5783.9	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C1O[Si](C)(C)C(C)(C)C	5765.0	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O[Si](C)(C)C(C)(C)C)=CC(O)=C3C2=O)C(O)C(O)C1O	5760.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O[Si](C)(C)C(C)(C)C)=C3C2=O)C(O)C(O)C1O	5751.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5770.1	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5758.7	Semi standard non polar	33892256
Quercetin 3-glucoside 7-xyloside,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(OC2=C(C3=CC=C(O)C(O)=C3)OC3=CC(OC4OCC(O)C(O)C4O)=CC(O)=C3C2=O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5751.2	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 - Quercetin 3-glucoside 7-xyloside GC-MS (1 TMS) - 70eV, Positive	splash10-0udr-5520019000-eccc5f4a1ab09dc654dd	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (Non-derivatized) - 70eV, Positive	splash10-0fb9-3500190000-0cbc0d360fa41b95203a	2017-11-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS ("Quercetin 3-glucoside 7-xyloside,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Quercetin 3-glucoside 7-xyloside GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-16	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 10V, Positive-QTOF	splash10-0171-0101940000-e20093c6519b1ca92480	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 20V, Positive-QTOF	splash10-0udi-0219800000-16c47e27e3a7658cedc8	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 40V, Positive-QTOF	splash10-0udi-1439200000-d5cb334dec0877eaf4c2	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 10V, Negative-QTOF	splash10-0002-2301980000-9c8605b2309b302d79b5	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 20V, Negative-QTOF	splash10-01q9-1422920000-84d0d212df935eabe84c	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 40V, Negative-QTOF	splash10-0007-9677200000-1e3faf015ac60d28ac4a	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 10V, Negative-QTOF	splash10-0002-0000090000-78cdc3f7a0e0ecdc199b	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 20V, Negative-QTOF	splash10-000t-0000590000-f10d270ebf336c2f91c2	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 40V, Negative-QTOF	splash10-001i-0000900000-8f69d233d7d4d8e524bb	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 10V, Positive-QTOF	splash10-000i-0000920000-7335b1eea3a22802799f	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 20V, Positive-QTOF	splash10-000k-0000990000-f30c9eb145947f49c47a	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Quercetin 3-glucoside 7-xyloside 40V, Positive-QTOF	splash10-000i-0000900000-f71e7aa5f9587ab5373f	2021-09-24	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

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB016395

KNApSAcK ID

C00057563

Chemspider ID

Not Available

KEGG Compound ID

Not Available

BioCyc ID

Not Available

BiGG ID

Not Available

Wikipedia Link

Not Available

METLIN ID

Not Available

PubChem Compound

74978152

PDB ID

Not Available

ChEBI ID

176247

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Showing metabocard for Quercetin 3-glucoside 7-xyloside (HMDB0037364)

MOL for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

3D MOL for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

3D SDF for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

3D-SDF for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

PDB for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

3D PDB for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

SMILES for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

INCHI for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

Structure for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

3D Structure for HMDB0037364 (Quercetin 3-glucoside 7-xyloside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra