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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 02:25:17 UTC

Update Date

2022-03-07 02:56:45 UTC

HMDB ID

HMDB0040831

Secondary Accession Numbers

HMDB40831

Metabolite Identification

Common Name

Rheinoside C

Description

Rheinoside C belongs to the class of organic compounds known as flavonoid-7-o-glucuronides. These are phenolic compounds containing a flavonoid moiety which is O-glycosidically linked to glucuronic acid at the C7-position. Rheinoside C has been detected, but not quantified in, green vegetables. This could make rheinoside C a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on Rheinoside C.

Structure

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

  Mrv0541 02241215192D          

 42 46  0  0  0  0            999 V2000
    0.7150    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286    2.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1435    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8570    2.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5720    1.6498    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2870    2.0623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149    3.2997    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4286    2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1435    3.2997    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8570    2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5720    3.2997    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1435    4.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149   -1.6499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001   -2.0623    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -1.6499    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149   -3.2998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001   -2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -3.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -4.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -2.0623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -3.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -4.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2870   -0.4126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5720   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5720   -1.6499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 31  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 41  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  2  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
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 17 23  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 25  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
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 24 27  1  0  0  0  0
 25 26  1  0  0  0  0
 28 29  1  0  0  0  0
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 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34 37  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  2  0  0  0  0
M  END

HMDB0040831
     RDKit          3D
Rheinoside C
 72 76  0  0  0  0  0  0  0  0999 V2000
   -4.9683    4.1763    2.2619 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9388    4.0880    2.9745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8766    4.8414    4.1137 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8195    3.2033    2.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7176    3.1392    3.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6312    2.3032    3.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4550    2.2419    3.8865 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7284    1.5486    1.9089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8530    1.6229    1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9316    2.4680    1.4556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880    0.6675    0.0139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2867    0.6239   -0.6903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2034   -0.3598   -1.7027 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3985   -0.4317   -2.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1798   -1.4523   -3.5179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8672   -2.6639   -2.8629 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.9616   -1.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0092   -2.1834   -1.9918 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8770   -1.2085   -0.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7786   -1.6582    0.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3721    0.1702    0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8789   -0.0730    1.5631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7571    0.4010   -0.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    0.0799   -2.0710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5450   -0.3394   -2.6202 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.4499   -1.8707 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6012   -0.1283   -0.5366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6897   -0.2076    0.2954 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9894   -0.6016   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3567   -1.5886    0.8758 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6163   -2.0926    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6875   -3.2325   -0.2988 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2867   -2.8563   -1.5550 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7056   -1.1064    0.4855 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6332   -1.6899   -0.4083 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2795    0.1889   -0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3412    0.1810   -1.5151 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8868    0.6030    0.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7614    0.8471    1.6375 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3979    0.2956    0.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4606    0.8666    1.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5053    0.7567    2.0748 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1041    5.3920    4.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5982    3.7005    4.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2967    1.8129    3.9587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7744    2.5268    0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0707   -0.3565    0.6679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5156    1.5905   -1.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6657    0.5258   -2.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2832   -1.1600   -4.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0811   -1.5808   -4.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
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   -6.3602   -0.2738   -1.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1582   -2.8072   -1.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833   -1.8269   -0.3073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3952   -2.3409    1.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2334    0.8494    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6073    0.1772    2.2008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5096    0.1730   -2.7136 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5242   -0.5718   -3.6869 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5893   -0.7779   -2.3359 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1533   -0.8771   -1.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8626   -2.6081    1.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7789   -3.5009   -0.3481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1793   -4.1226    0.0952 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414   -3.6326   -1.9885 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2871   -0.8891    1.4206 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7523   -1.1675   -1.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9662    0.9905    0.2179 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7206    0.8821   -1.8264 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    1.4883   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3441    1.5323    1.9996 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
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  6  8  2  0
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 21 22  1  0
 11 23  1  0
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 31 32  1  0
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 34 35  1  0
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 36 37  1  0
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 38 39  1  0
 27 40  2  0
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 10  4  1  0
 21 12  1  0
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 41  8  1  0
 38 29  1  0
  3 43  1  0
  5 44  1  0
  7 45  1  0
 10 46  1  0
 11 47  1  0
 12 48  1  0
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 25 60  1  0
 26 61  1  0
 29 62  1  0
 31 63  1  0
 32 64  1  0
 32 65  1  0
 33 66  1  0
 34 67  1  0
 35 68  1  0
 36 69  1  0
 37 70  1  0
 38 71  1  0
 39 72  1  0
M  END

  Mrv0541 02241215192D          

 42 46  0  0  0  0            999 V2000
    0.7150    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8570    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001    0.4124    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
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    0.0001   -0.4126    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149    1.6498    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
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    0.7150   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7149   -3.2998    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.0001   -2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -3.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7150   -4.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -2.0623    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.4286   -2.8873    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -3.2998    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1435   -4.1247    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.2870   -0.4126    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.5720   -0.8249    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5720   -1.6499    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2 10  1  0  0  0  0
  3  4  2  0  0  0  0
  3  8  1  0  0  0  0
  4  5  1  0  0  0  0
  4 31  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  6 41  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
 10 11  1  0  0  0  0
 10 15  2  0  0  0  0
 11 12  2  0  0  0  0
 11 16  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 31  1  0  0  0  0
 16 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 23  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 19 25  1  0  0  0  0
 20 21  1  0  0  0  0
 22 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 27  1  0  0  0  0
 25 26  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 29 33  1  0  0  0  0
 30 31  1  0  0  0  0
 30 36  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 34 35  1  0  0  0  0
 34 37  1  0  0  0  0
 36 37  1  0  0  0  0
 37 38  1  0  0  0  0
 38 39  1  0  0  0  0
 40 41  1  0  0  0  0
 41 42  2  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0040831

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O

> <INCHI_IDENTIFIER>
InChI=1S/C27H30O15/c28-6-13-18(31)21(34)23(36)25(40-13)15-9-2-1-3-12(41-27-24(37)22(35)19(32)14(7-29)42-27)17(9)20(33)16-10(15)4-8(26(38)39)5-11(16)30/h1-5,13-15,18-19,21-25,27-32,34-37H,6-7H2,(H,38,39)

> <INCHI_KEY>
GLHYGFIHRKNBBP-UHFFFAOYSA-N

> <FORMULA>
C27H30O15

> <MOLECULAR_WEIGHT>
594.5181

> <EXACT_MASS>
594.15847029

> <JCHEM_ACCEPTOR_COUNT>
15

> <JCHEM_AVERAGE_POLARIZABILITY>
56.570263775159994

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
4-hydroxy-10-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-2-carboxylic acid

> <ALOGPS_LOGP>
-1.58

> <JCHEM_LOGP>
-2.078145692333334

> <ALOGPS_LOGS>
-1.92

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
5

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
9.882471117818561

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.5223950660165273

> <JCHEM_PKA_STRONGEST_BASIC>
-3.644126575110721

> <JCHEM_POLAR_SURFACE_AREA>
264.12999999999994

> <JCHEM_REFRACTIVITY>
136.37780000000004

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
7.23e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
4-hydroxy-10-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9H-anthracene-2-carboxylic acid

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0040831
     RDKit          3D
Rheinoside C
 72 76  0  0  0  0  0  0  0  0999 V2000
   -4.9683    4.1763    2.2619 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9388    4.0880    2.9745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8766    4.8414    4.1137 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8195    3.2033    2.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7176    3.1392    3.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6312    2.3032    3.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4550    2.2419    3.8865 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7284    1.5486    1.9089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8530    1.6229    1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9316    2.4680    1.4556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880    0.6675    0.0139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2867    0.6239   -0.6903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2034   -0.3598   -1.7027 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3985   -0.4317   -2.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1798   -1.4523   -3.5179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8672   -2.6639   -2.8629 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.9616   -1.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0092   -2.1834   -1.9918 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8770   -1.2085   -0.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7786   -1.6582    0.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3721    0.1702    0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8789   -0.0730    1.5631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7571    0.4010   -0.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    0.0799   -2.0710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5450   -0.3394   -2.6202 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.4499   -1.8707 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6012   -0.1283   -0.5366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6897   -0.2076    0.2954 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9894   -0.6016   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3567   -1.5886    0.8758 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6163   -2.0926    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6875   -3.2325   -0.2988 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2867   -2.8563   -1.5550 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7056   -1.1064    0.4855 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6332   -1.6899   -0.4083 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2795    0.1889   -0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3412    0.1810   -1.5151 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8868    0.6030    0.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7614    0.8471    1.6375 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3979    0.2956    0.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4606    0.8666    1.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5053    0.7567    2.0748 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1041    5.3920    4.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5982    3.7005    4.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2967    1.8129    3.9587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7744    2.5268    0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0707   -0.3565    0.6679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5156    1.5905   -1.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6657    0.5258   -2.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2832   -1.1600   -4.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0811   -1.5808   -4.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1835   -3.1760   -3.3213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3602   -0.2738   -1.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1582   -2.8072   -1.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833   -1.8269   -0.3073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3952   -2.3409    1.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2334    0.8494    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6073    0.1772    2.2008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5096    0.1730   -2.7136 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5242   -0.5718   -3.6869 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5893   -0.7779   -2.3359 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1533   -0.8771   -1.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8626   -2.6081    1.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7789   -3.5009   -0.3481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1793   -4.1226    0.0952 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414   -3.6326   -1.9885 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2871   -0.8891    1.4206 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7523   -1.1675   -1.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9662    0.9905    0.2179 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7206    0.8821   -1.8264 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    1.4883   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3441    1.5323    1.9996 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  6  8  2  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 14 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 11 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  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
 31 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36 38  1  0
 38 39  1  0
 27 40  2  0
 40 41  1  0
 41 42  2  0
 10  4  1  0
 21 12  1  0
 40 23  1  0
 41  8  1  0
 38 29  1  0
  3 43  1  0
  5 44  1  0
  7 45  1  0
 10 46  1  0
 11 47  1  0
 12 48  1  0
 14 49  1  0
 15 50  1  0
 15 51  1  0
 16 52  1  0
 17 53  1  0
 18 54  1  0
 19 55  1  0
 20 56  1  0
 21 57  1  0
 22 58  1  0
 24 59  1  0
 25 60  1  0
 26 61  1  0
 29 62  1  0
 31 63  1  0
 32 64  1  0
 32 65  1  0
 33 66  1  0
 34 67  1  0
 35 68  1  0
 36 69  1  0
 37 70  1  0
 38 71  1  0
 39 72  1  0
M  END

HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  O   UNK     0       1.335   3.080   0.000  0.00  0.00           O+0
HETATM    2  C   UNK     0       1.335   1.540   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.667   0.770   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       2.667  -0.770   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       4.001  -1.540   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       5.333  -0.770   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0       5.333   0.770   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0       4.001   1.540   0.000  0.00  0.00           C+0
HETATM    9  O   UNK     0       4.001   3.080   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0       0.000   0.770   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -1.334   1.540   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -2.667   0.770   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -2.667  -0.770   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.334  -1.540   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       0.000  -0.770   0.000  0.00  0.00           C+0
HETATM   16  O   UNK     0      -1.334   3.080   0.000  0.00  0.00           O+0
HETATM   17  C   UNK     0      -2.667   3.850   0.000  0.00  0.00           C+0
HETATM   18  O   UNK     0      -4.001   3.080   0.000  0.00  0.00           O+0
HETATM   19  C   UNK     0      -5.333   3.850   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -6.668   3.080   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      -8.002   3.850   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0      -1.334   6.159   0.000  0.00  0.00           O+0
HETATM   23  C   UNK     0      -2.667   5.390   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0      -4.001   6.159   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0      -5.333   5.390   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -6.668   6.159   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      -4.001   7.699   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      -1.334  -3.080   0.000  0.00  0.00           O+0
HETATM   29  C   UNK     0       0.000  -3.850   0.000  0.00  0.00           C+0
HETATM   30  C   UNK     0       1.335  -3.080   0.000  0.00  0.00           C+0
HETATM   31  C   UNK     0       1.335  -1.540   0.000  0.00  0.00           C+0
HETATM   32  O   UNK     0      -1.334  -6.160   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0       0.000  -5.390   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0       1.335  -6.160   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0       1.335  -7.699   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0       2.667  -3.850   0.000  0.00  0.00           O+0
HETATM   37  C   UNK     0       2.667  -5.390   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0       4.001  -6.160   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0       4.001  -7.699   0.000  0.00  0.00           O+0
HETATM   40  O   UNK     0       8.002  -0.770   0.000  0.00  0.00           O+0
HETATM   41  C   UNK     0       6.668  -1.540   0.000  0.00  0.00           C+0
HETATM   42  O   UNK     0       6.668  -3.080   0.000  0.00  0.00           O+0
CONECT    1    2                                                            
CONECT    2    1    3   10                                                  
CONECT    3    2    4    8                                                  
CONECT    4    3    5   31                                                  
CONECT    5    4    6                                                       
CONECT    6    5    7   41                                                  
CONECT    7    6    8                                                       
CONECT    8    3    7    9                                                  
CONECT    9    8                                                            
CONECT   10    2   11   15                                                  
CONECT   11   10   12   16                                                  
CONECT   12   11   13                                                       
CONECT   13   12   14                                                       
CONECT   14   13   15                                                       
CONECT   15   10   14   31                                                  
CONECT   16   11   17                                                       
CONECT   17   16   18   23                                                  
CONECT   18   17   19                                                       
CONECT   19   18   20   25                                                  
CONECT   20   19   21                                                       
CONECT   21   20                                                            
CONECT   22   23                                                            
CONECT   23   17   22   24                                                  
CONECT   24   23   25   27                                                  
CONECT   25   19   24   26                                                  
CONECT   26   25                                                            
CONECT   27   24                                                            
CONECT   28   29                                                            
CONECT   29   28   30   33                                                  
CONECT   30   29   31   36                                                  
CONECT   31    4   15   30                                                  
CONECT   32   33                                                            
CONECT   33   29   32   34                                                  
CONECT   34   33   35   37                                                  
CONECT   35   34                                                            
CONECT   36   30   37                                                       
CONECT   37   34   36   38                                                  
CONECT   38   37   39                                                       
CONECT   39   38                                                            
CONECT   40   41                                                            
CONECT   41    6   40   42                                                  
CONECT   42   41                                                            
MASTER        0    0    0    0    0    0    0    0   42    0   92    0
END

COMPND    HMDB0040831
HETATM    1  O1  UNL     1      -4.968   4.176   2.262  1.00  0.00           O  
HETATM    2  C1  UNL     1      -3.939   4.088   2.975  1.00  0.00           C  
HETATM    3  O2  UNL     1      -3.877   4.841   4.114  1.00  0.00           O  
HETATM    4  C2  UNL     1      -2.820   3.203   2.609  1.00  0.00           C  
HETATM    5  C3  UNL     1      -1.718   3.139   3.416  1.00  0.00           C  
HETATM    6  C4  UNL     1      -0.631   2.303   3.086  1.00  0.00           C  
HETATM    7  O3  UNL     1       0.455   2.242   3.886  1.00  0.00           O  
HETATM    8  C5  UNL     1      -0.728   1.549   1.909  1.00  0.00           C  
HETATM    9  C6  UNL     1      -1.853   1.623   1.116  1.00  0.00           C  
HETATM   10  C7  UNL     1      -2.932   2.468   1.456  1.00  0.00           C  
HETATM   11  C8  UNL     1      -1.988   0.667   0.014  1.00  0.00           C  
HETATM   12  C9  UNL     1      -3.287   0.624  -0.690  1.00  0.00           C  
HETATM   13  O4  UNL     1      -3.203  -0.360  -1.703  1.00  0.00           O  
HETATM   14  C10 UNL     1      -4.399  -0.432  -2.419  1.00  0.00           C  
HETATM   15  C11 UNL     1      -4.180  -1.452  -3.518  1.00  0.00           C  
HETATM   16  O5  UNL     1      -3.867  -2.664  -2.863  1.00  0.00           O  
HETATM   17  C12 UNL     1      -5.519  -0.962  -1.539  1.00  0.00           C  
HETATM   18  O6  UNL     1      -6.009  -2.183  -1.992  1.00  0.00           O  
HETATM   19  C13 UNL     1      -4.877  -1.208  -0.186  1.00  0.00           C  
HETATM   20  O7  UNL     1      -5.779  -1.658   0.749  1.00  0.00           O  
HETATM   21  C14 UNL     1      -4.372   0.170   0.294  1.00  0.00           C  
HETATM   22  O8  UNL     1      -3.879  -0.073   1.563  1.00  0.00           O  
HETATM   23  C15 UNL     1      -0.757   0.401  -0.712  1.00  0.00           C  
HETATM   24  C16 UNL     1      -0.674   0.080  -2.071  1.00  0.00           C  
HETATM   25  C17 UNL     1       0.545  -0.339  -2.620  1.00  0.00           C  
HETATM   26  C18 UNL     1       1.683  -0.450  -1.871  1.00  0.00           C  
HETATM   27  C19 UNL     1       1.601  -0.128  -0.537  1.00  0.00           C  
HETATM   28  O9  UNL     1       2.690  -0.208   0.295  1.00  0.00           O  
HETATM   29  C20 UNL     1       3.989  -0.602  -0.032  1.00  0.00           C  
HETATM   30  O10 UNL     1       4.357  -1.589   0.876  1.00  0.00           O  
HETATM   31  C21 UNL     1       5.616  -2.093   0.723  1.00  0.00           C  
HETATM   32  C22 UNL     1       5.687  -3.232  -0.299  1.00  0.00           C  
HETATM   33  O11 UNL     1       5.287  -2.856  -1.555  1.00  0.00           O  
HETATM   34  C23 UNL     1       6.706  -1.106   0.486  1.00  0.00           C  
HETATM   35  O12 UNL     1       7.633  -1.690  -0.408  1.00  0.00           O  
HETATM   36  C24 UNL     1       6.279   0.189  -0.121  1.00  0.00           C  
HETATM   37  O13 UNL     1       6.341   0.181  -1.515  1.00  0.00           O  
HETATM   38  C25 UNL     1       4.887   0.603   0.293  1.00  0.00           C  
HETATM   39  O14 UNL     1       4.761   0.847   1.638  1.00  0.00           O  
HETATM   40  C26 UNL     1       0.398   0.296   0.034  1.00  0.00           C  
HETATM   41  C27 UNL     1       0.461   0.867   1.399  1.00  0.00           C  
HETATM   42  O15 UNL     1       1.505   0.757   2.075  1.00  0.00           O  
HETATM   43  H1  UNL     1      -3.104   5.392   4.422  1.00  0.00           H  
HETATM   44  H2  UNL     1      -1.598   3.700   4.330  1.00  0.00           H  
HETATM   45  H3  UNL     1       1.297   1.813   3.959  1.00  0.00           H  
HETATM   46  H4  UNL     1      -3.774   2.527   0.814  1.00  0.00           H  
HETATM   47  H5  UNL     1      -2.071  -0.356   0.668  1.00  0.00           H  
HETATM   48  H6  UNL     1      -3.516   1.591  -1.147  1.00  0.00           H  
HETATM   49  H7  UNL     1      -4.666   0.526  -2.912  1.00  0.00           H  
HETATM   50  H8  UNL     1      -3.283  -1.160  -4.067  1.00  0.00           H  
HETATM   51  H9  UNL     1      -5.081  -1.581  -4.146  1.00  0.00           H  
HETATM   52  H10 UNL     1      -3.184  -3.176  -3.321  1.00  0.00           H  
HETATM   53  H11 UNL     1      -6.360  -0.274  -1.441  1.00  0.00           H  
HETATM   54  H12 UNL     1      -6.158  -2.807  -1.220  1.00  0.00           H  
HETATM   55  H13 UNL     1      -3.983  -1.827  -0.307  1.00  0.00           H  
HETATM   56  H14 UNL     1      -5.395  -2.341   1.346  1.00  0.00           H  
HETATM   57  H15 UNL     1      -5.233   0.849   0.239  1.00  0.00           H  
HETATM   58  H16 UNL     1      -4.607   0.177   2.201  1.00  0.00           H  
HETATM   59  H17 UNL     1      -1.510   0.173  -2.714  1.00  0.00           H  
HETATM   60  H18 UNL     1       0.524  -0.572  -3.687  1.00  0.00           H  
HETATM   61  H19 UNL     1       2.589  -0.778  -2.336  1.00  0.00           H  
HETATM   62  H20 UNL     1       4.153  -0.877  -1.069  1.00  0.00           H  
HETATM   63  H21 UNL     1       5.863  -2.608   1.701  1.00  0.00           H  
HETATM   64  H22 UNL     1       6.779  -3.501  -0.348  1.00  0.00           H  
HETATM   65  H23 UNL     1       5.179  -4.123   0.095  1.00  0.00           H  
HETATM   66  H24 UNL     1       4.841  -3.633  -1.989  1.00  0.00           H  
HETATM   67  H25 UNL     1       7.287  -0.889   1.421  1.00  0.00           H  
HETATM   68  H26 UNL     1       7.752  -1.167  -1.219  1.00  0.00           H  
HETATM   69  H27 UNL     1       6.966   0.991   0.218  1.00  0.00           H  
HETATM   70  H28 UNL     1       5.721   0.882  -1.826  1.00  0.00           H  
HETATM   71  H29 UNL     1       4.601   1.488  -0.281  1.00  0.00           H  
HETATM   72  H30 UNL     1       5.344   1.532   2.000  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3    4
CONECT    3   43
CONECT    4    5    5   10
CONECT    5    6   44
CONECT    6    7    8    8
CONECT    7   45
CONECT    8    9   41
CONECT    9   10   10   11
CONECT   10   46
CONECT   11   12   23   47
CONECT   12   13   21   48
CONECT   13   14
CONECT   14   15   17   49
CONECT   15   16   50   51
CONECT   16   52
CONECT   17   18   19   53
CONECT   18   54
CONECT   19   20   21   55
CONECT   20   56
CONECT   21   22   57
CONECT   22   58
CONECT   23   24   24   40
CONECT   24   25   59
CONECT   25   26   26   60
CONECT   26   27   61
CONECT   27   28   40   40
CONECT   28   29
CONECT   29   30   38   62
CONECT   30   31
CONECT   31   32   34   63
CONECT   32   33   64   65
CONECT   33   66
CONECT   34   35   36   67
CONECT   35   68
CONECT   36   37   38   69
CONECT   37   70
CONECT   38   39   71
CONECT   39   72
CONECT   40   41
CONECT   41   42   42
END

HMDB0040831
     RDKit          3D
Rheinoside C
 72 76  0  0  0  0  0  0  0  0999 V2000
   -4.9683    4.1763    2.2619 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9388    4.0880    2.9745 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8766    4.8414    4.1137 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8195    3.2033    2.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7176    3.1392    3.4159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6312    2.3032    3.0864 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4550    2.2419    3.8865 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7284    1.5486    1.9089 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8530    1.6229    1.1164 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9316    2.4680    1.4556 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9880    0.6675    0.0139 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2867    0.6239   -0.6903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2034   -0.3598   -1.7027 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3985   -0.4317   -2.4195 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1798   -1.4523   -3.5179 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8672   -2.6639   -2.8629 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.9616   -1.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0092   -2.1834   -1.9918 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8770   -1.2085   -0.1864 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7786   -1.6582    0.7494 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3721    0.1702    0.2939 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8789   -0.0730    1.5631 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7571    0.4010   -0.7121 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6736    0.0799   -2.0710 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5450   -0.3394   -2.6202 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6830   -0.4499   -1.8707 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6012   -0.1283   -0.5366 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6897   -0.2076    0.2954 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.9894   -0.6016   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3567   -1.5886    0.8758 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.6163   -2.0926    0.7227 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6875   -3.2325   -0.2988 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2867   -2.8563   -1.5550 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.7056   -1.1064    0.4855 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6332   -1.6899   -0.4083 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.2795    0.1889   -0.1207 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3412    0.1810   -1.5151 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.8868    0.6030    0.2931 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7614    0.8471    1.6375 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.3979    0.2956    0.0336 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4606    0.8666    1.3991 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5053    0.7567    2.0748 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1041    5.3920    4.4217 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5982    3.7005    4.3302 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2967    1.8129    3.9587 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7744    2.5268    0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0707   -0.3565    0.6679 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5156    1.5905   -1.1472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6657    0.5258   -2.9115 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2832   -1.1600   -4.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0811   -1.5808   -4.1456 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1835   -3.1760   -3.3213 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3602   -0.2738   -1.4410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1582   -2.8072   -1.2200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9833   -1.8269   -0.3073 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3952   -2.3409    1.3465 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2334    0.8494    0.2386 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6073    0.1772    2.2008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5096    0.1730   -2.7136 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5242   -0.5718   -3.6869 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5893   -0.7779   -2.3359 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1533   -0.8771   -1.0692 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8626   -2.6081    1.7010 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.7789   -3.5009   -0.3481 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1793   -4.1226    0.0952 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.8414   -3.6326   -1.9885 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2871   -0.8891    1.4206 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7523   -1.1675   -1.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9662    0.9905    0.2179 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7206    0.8821   -1.8264 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6006    1.4883   -0.2806 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3441    1.5323    1.9996 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  2  4  1  0
  4  5  2  0
  5  6  1  0
  6  7  1  0
  6  8  2  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 14 17  1  0
 17 18  1  0
 17 19  1  0
 19 20  1  0
 19 21  1  0
 21 22  1  0
 11 23  1  0
 23 24  2  0
 24 25  1  0
 25 26  2  0
 26 27  1  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
 31 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 36 38  1  0
 38 39  1  0
 27 40  2  0
 40 41  1  0
 41 42  2  0
 10  4  1  0
 21 12  1  0
 40 23  1  0
 41  8  1  0
 38 29  1  0
  3 43  1  0
  5 44  1  0
  7 45  1  0
 10 46  1  0
 11 47  1  0
 12 48  1  0
 14 49  1  0
 15 50  1  0
 15 51  1  0
 16 52  1  0
 17 53  1  0
 18 54  1  0
 19 55  1  0
 20 56  1  0
 21 57  1  0
 22 58  1  0
 24 59  1  0
 25 60  1  0
 26 61  1  0
 29 62  1  0
 31 63  1  0
 32 64  1  0
 32 65  1  0
 33 66  1  0
 34 67  1  0
 35 68  1  0
 36 69  1  0
 37 70  1  0
 38 71  1  0
 39 72  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
4-Hydroxy-10-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-2-carboxylate	HMDB

Chemical Formula

C₂₇H₃₀O₁₅

Average Molecular Weight

594.5181

Monoisotopic Molecular Weight

594.15847029

IUPAC Name

4-hydroxy-10-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9,10-dihydroanthracene-2-carboxylic acid

Traditional Name

4-hydroxy-10-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-9H-anthracene-2-carboxylic acid

CAS Registry Number

111545-29-0

SMILES

OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O

InChI Identifier

InChI=1S/C27H30O15/c28-6-13-18(31)21(34)23(36)25(40-13)15-9-2-1-3-12(41-27-24(37)22(35)19(32)14(7-29)42-27)17(9)20(33)16-10(15)4-8(26(38)39)5-11(16)30/h1-5,13-15,18-19,21-25,27-32,34-37H,6-7H2,(H,38,39)

InChI Key

GLHYGFIHRKNBBP-UHFFFAOYSA-N

Chemical Taxonomy

Description

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

Kingdom

Organic compounds

Super Class

Phenylpropanoids and polyketides

Class

Flavonoids

Sub Class

Flavonoid glycosides

Direct Parent

Flavonoid-7-O-glucuronides

Alternative Parents

Substituents

Flavonoid-7-o-glucuronide
Flavonoid-7-o-glycoside
Hydroxyflavonoid
Flavone
6-hydroxyflavonoid
5-hydroxyflavonoid
4'-hydroxyflavonoid
Phenolic glycoside
O-glucuronide
1-o-glucuronide
Glucuronic acid or derivatives
Chromone
Disaccharide
Glycosyl compound
O-glycosyl compound
1-benzopyran
Benzopyran
Beta-hydroxy acid
1-hydroxy-2-unsubstituted benzenoid
1-hydroxy-4-unsubstituted benzenoid
Pyranone
Phenol
Monocyclic benzene moiety
Dicarboxylic acid or derivatives
Benzenoid
Pyran
Hydroxy acid
Oxane
Vinylogous acid
Heteroaromatic compound
Secondary alcohol
Organoheterocyclic compound
Carboxylic acid
Carboxylic acid derivative
Oxacycle
Acetal
Polyol
Hydrocarbon derivative
Organic oxide
Carbonyl group
Organic oxygen compound
Alcohol
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: HMDB0040831)
Cytoplasm (HMDB: HMDB0040831)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0040831)

Source

Exogenous

Exogenous (HMDB: HMDB0040831)

Food

Food (HMDB: HMDB0040831)

Vegetable

Leaf vegetable

Green vegetables (FooDB: FOOD00872)

Endogenous

Plant

Plant (HMDB: HMDB0040831)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0040831)

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	7.23 g/L	ALOGPS
logP	-1.6	ALOGPS
logP	-2.1	ChemAxon
logS	-1.9	ALOGPS
pKa (Strongest Acidic)	3.52	ChemAxon
pKa (Strongest Basic)	-3.6	ChemAxon
Physiological Charge	-1	ChemAxon
Hydrogen Acceptor Count	15	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	264.13 Å²	ChemAxon
Rotatable Bond Count	6	ChemAxon
Refractivity	136.38 m³·mol⁻¹	ChemAxon
Polarizability	56.57 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]+	235.079	31661259
DarkChem	[M-H]-	221.713	31661259
DeepCCS	[M+H]+	225.393	30932474
DeepCCS	[M-H]-	223.104	30932474
DeepCCS	[M-2H]-	256.344	30932474
DeepCCS	[M+Na]+	231.305	30932474
AllCCS	[M+H]+	229.5	32859911
AllCCS	[M+H-H2O]+	228.3	32859911
AllCCS	[M+NH4]+	230.6	32859911
AllCCS	[M+Na]+	231.0	32859911
AllCCS	[M-H]-	225.9	32859911
AllCCS	[M+Na-2H]-	227.6	32859911
AllCCS	[M+HCOO]-	229.7	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Rheinoside C	OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	4958.2	Standard polar	33892256
Rheinoside C	OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	4739.8	Standard non polar	33892256
Rheinoside C	OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(C=C(C=C2O)C(O)=O)C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5392.0	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Rheinoside C,1TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5282.3	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #10	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C1O	5318.4	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #2	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5332.7	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #3	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5246.2	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #4	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5275.9	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #5	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C1O	5300.7	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #6	C[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C1O	5283.4	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #7	C[Si](C)(C)OC1C(O)C(O)C(CO)OC1C1C2=CC(C(=O)O)=CC(O)=C2C(=O)C2=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C21	5288.3	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #8	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C1O	5307.3	Semi standard non polar	33892256
Rheinoside C,1TMS,isomer #9	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C1O	5292.0	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5176.4	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #10	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5167.0	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #11	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5212.7	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #12	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5178.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #13	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5209.6	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #14	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	5184.6	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #15	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5193.9	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #16	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5165.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #17	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5181.3	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #18	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5119.9	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #19	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	5126.4	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5119.0	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #20	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	5096.2	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #21	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	5119.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #22	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5144.6	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #23	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5113.2	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #24	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5141.5	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #25	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5162.0	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #26	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	5131.8	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #27	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	5163.4	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #28	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	5146.0	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #29	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	5134.7	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O	5152.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #30	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	5156.5	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #31	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1O	5170.2	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #32	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C1O	5140.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #33	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C1O	5173.7	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #34	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C1O	5148.7	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #35	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C1O[Si](C)(C)C	5168.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #36	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1O	5148.8	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #37	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C1O	5115.2	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #38	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O	5150.3	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #39	C[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C1O[Si](C)(C)C	5166.5	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5148.5	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #40	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1O	5162.9	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #41	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C1O	5132.9	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #42	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(O)C1O	5165.3	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #43	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O	5181.1	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #44	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C	5200.2	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #45	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C	5175.4	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5125.5	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5137.3	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5178.8	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5153.6	Semi standard non polar	33892256
Rheinoside C,2TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5171.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	4982.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	4960.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #100	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5047.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #101	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O	5064.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #102	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1O	5050.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #103	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C1O	5070.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #104	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C1O	5050.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #105	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C1O	5088.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #106	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C1O	5013.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #107	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C1O	5028.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #108	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C1O	5051.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #109	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(O)C1O	5066.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4928.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #110	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5082.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #111	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	5066.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #112	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	5045.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #113	C[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C1O	5018.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #114	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	5029.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #115	C[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C1O	5060.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #116	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O	5069.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #117	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5066.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #118	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5044.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #119	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	5081.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4957.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #120	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5131.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5017.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4964.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4999.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5009.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4988.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5001.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #19	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	5052.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O	5026.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #20	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	5002.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #21	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5033.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	5023.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5002.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5065.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5019.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5050.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	5023.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	5036.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4983.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	5032.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	5020.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	5055.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	5014.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	5041.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5092.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5099.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5062.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #37	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O)C1O	4989.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #38	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	5013.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #39	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4969.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4994.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #40	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	5008.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #41	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5038.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #42	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4985.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #43	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5039.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #44	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5085.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #45	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5105.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #46	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	5076.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #47	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5089.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #48	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5056.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #49	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5082.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	5023.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #50	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5124.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #51	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	5025.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #52	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5036.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #53	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	4995.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #54	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5035.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #55	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	5081.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #56	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	5089.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #57	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	5057.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #58	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	5082.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #59	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O)C1O	5052.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	5093.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #60	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O[Si](C)(C)C)C1O	5031.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #61	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O[Si](C)(C)C	5060.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #62	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5070.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #63	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5056.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #64	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5071.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #65	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O	4990.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #66	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	4942.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #67	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4990.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #68	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4966.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #69	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4952.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	5042.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #70	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4978.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #71	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2=C1	4991.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #72	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2=C1	4979.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #73	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	5008.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #74	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4962.8	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #75	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	5008.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #76	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4989.5	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #77	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4973.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #78	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4925.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #79	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4974.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	5071.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #80	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	5003.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #81	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4956.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #82	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	5004.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #83	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4996.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #84	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5019.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #85	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5032.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #86	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	5035.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #87	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	5052.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #88	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	5046.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #89	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	5035.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O	4939.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #90	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	5054.2	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #91	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	5076.0	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #92	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	5002.6	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #93	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4988.9	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #94	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	5014.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #95	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	5047.3	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #96	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	5037.1	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #97	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	5056.7	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #98	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	5033.4	Semi standard non polar	33892256
Rheinoside C,3TMS,isomer #99	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	5021.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O	4808.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4858.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #100	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4871.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #101	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4806.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #102	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4875.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #103	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4869.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #104	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4900.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #105	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4896.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #106	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5000.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #107	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4909.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #108	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	4910.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #109	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	4868.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #11	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO[Si](C)(C)C)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4925.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #110	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	4902.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #111	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4931.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #112	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	4934.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #113	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	4896.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #114	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	4928.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #115	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O)C1O	4905.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #116	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O[Si](C)(C)C)C1O	4893.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #117	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O[Si](C)(C)C	4911.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #118	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4918.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #119	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4908.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #12	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4870.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #120	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4912.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #121	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4937.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #122	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O	4942.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #123	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O	4897.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #124	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C	4934.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #125	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O)C1O	4847.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #126	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O[Si](C)(C)C)C1O	4833.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #127	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O[Si](C)(C)C	4855.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #128	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4864.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #129	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4850.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #13	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	4899.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #130	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4853.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #131	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O)C1O	4914.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #132	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O[Si](C)(C)C)C1O	4897.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #133	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O[Si](C)(C)C	4918.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #134	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4925.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #135	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4915.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #136	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4921.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #137	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4893.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #138	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4883.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #139	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4907.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4870.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #140	C[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4932.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #141	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	4837.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #142	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4862.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #143	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4832.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #144	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4825.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #145	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4846.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #146	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4860.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #147	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4772.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #148	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4766.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #149	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4790.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4856.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #150	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4836.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #151	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4831.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #152	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4849.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #153	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4820.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #154	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4809.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #155	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4841.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #156	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4860.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #157	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2=C1	4854.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #158	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2=C1	4797.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #159	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2=C1	4858.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4927.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #160	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2=C1	4845.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #161	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2=C1	4782.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #162	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2=C1	4849.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #163	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4843.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #164	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4871.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #165	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4871.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #166	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4843.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #167	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4784.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #168	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4848.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #169	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4805.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4870.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #170	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4829.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #171	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4831.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #172	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4832.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #173	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4862.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #174	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2=C1	4860.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #175	C[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	4916.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #176	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4956.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #177	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4886.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #178	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4871.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #179	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4893.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4902.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #180	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4907.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #181	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4893.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #182	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4910.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #183	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4903.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #184	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4886.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #185	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4919.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #186	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4913.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #187	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4896.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #188	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C	4918.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #189	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4844.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4863.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #190	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4829.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #191	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4863.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #192	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4907.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #193	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4890.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #194	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4921.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #195	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4908.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #196	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O	4937.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #197	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1O	4912.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #198	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1O[Si](C)(C)C	4889.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #199	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4901.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	4819.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4890.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #200	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C1O	4878.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #201	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C1O	4964.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #202	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O[Si](C)(C)C)C1O	4908.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #203	C[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C1O[Si](C)(C)C	4918.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #204	C[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C1O	4881.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #205	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O	4936.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #206	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4908.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #207	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4881.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #208	C[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C1O	4924.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #209	C[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	4911.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4828.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #210	C[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4955.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #22	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4870.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4918.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4865.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4894.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4966.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4978.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4935.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	4794.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4782.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4782.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4780.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #32	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4862.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #33	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	4805.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #34	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O	4840.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4810.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4796.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4867.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4804.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #39	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4849.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4815.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #40	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4798.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #41	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4832.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4767.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4814.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4861.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4796.0	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4842.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4899.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4923.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4869.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4889.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4876.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O	4840.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O	4911.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4860.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4891.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4861.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4897.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4841.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #58	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C)C1O	4879.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4909.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O	4829.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #60	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4851.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #61	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C)C(O)C1O	4888.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #62	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4961.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #63	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C4O[Si](C)(C)C)C=CC=C32)C(O)C(O)C1O	4944.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #64	C[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	4920.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O	4886.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O	4917.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O	4859.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O[Si](C)(C)C	4898.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #69	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4904.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C	4868.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #70	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4847.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #71	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4883.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #72	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4942.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #73	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4960.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #74	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4916.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4912.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #76	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4849.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #77	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4891.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #78	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4902.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #79	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4923.1	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C(O)C(O)C1O	4858.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #80	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4875.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #81	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4936.3	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #82	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4955.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #83	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4908.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #84	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	5022.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #85	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O)C1O	4862.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #86	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O)C1O	4804.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #87	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O)C1O	4868.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #88	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O[Si](C)(C)C)C(O)C1O	4827.7	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #89	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O[Si](C)(C)C)C1O	4816.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C(O)C(O)C1O	4840.9	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #90	C[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C)C=C(C(=O)O[Si](C)(C)C)C=C32)C(O)C(O)C1O[Si](C)(C)C	4837.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #91	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2=C1	4854.6	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #92	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2=C1	4845.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #93	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4879.5	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #94	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4817.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #95	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2=C1	4881.8	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #96	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2=C1	4839.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #97	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4835.4	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #98	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4776.2	Semi standard non polar	33892256
Rheinoside C,4TMS,isomer #99	C[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2=C1	4839.6	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5466.5	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C1O	5535.2	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5494.2	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5504.2	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5452.7	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C1O	5511.3	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C1O	5498.5	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(O)C(O)C(CO)OC1C1C2=CC(C(=O)O)=CC(O)=C2C(=O)C2=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C21	5493.7	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C1O	5521.6	Semi standard non polar	33892256
Rheinoside C,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C1O	5512.1	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5541.7	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O[Si](C)(C)C(C)(C)C)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5564.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5589.2	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5558.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C=CC=C1C2C1OC(CO)C(O)C(O)C1O	5586.4	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC=CC(OC4OC(CO)C(O)C(O)C4O)=C3C(=O)C3=C(O[Si](C)(C)C(C)(C)C)C=C(C(=O)O)C=C32)C(O)C(O)C1O	5541.4	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5556.2	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5542.6	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)O)=CC2=C1C(=O)C1=C(OC3OC(CO)C(O)C(O)C3O)C=CC=C1C2C1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5547.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O[Si](C)(C)C(C)(C)C)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5515.0	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2=C1	5534.2	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O[Si](C)(C)C(C)(C)C)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O	5525.1	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2=C1	5523.3	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2=C1	5530.7	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5568.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5537.8	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC(=O)C1=CC(O)=C2C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C=CC=C3C(C3OC(CO)C(O)C(O)C3O)C2=C1	5562.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C4O)C=CC=C32)C(O)C(O)C1O	5538.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C=CC=C32)C(O)C(O)C1O	5507.1	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C=CC=C32)C(O)C(O)C1O	5531.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5499.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5519.3	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C(O)C(O)C1O	5501.3	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OCC1OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5508.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1O	5557.6	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C4O)C=CC=C32)C(O)C1O	5526.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O[Si](C)(C)C(C)(C)C)C=CC=C32)C(O)C1O	5547.1	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O[Si](C)(C)C(C)(C)C)C1O	5525.3	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C(O)C1O[Si](C)(C)C(C)(C)C	5541.0	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1O	5546.2	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C1O	5514.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(O)C1O	5535.2	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(C2C3=CC(C(=O)O)=CC(O)=C3C(=O)C3=C(OC4OC(CO)C(O)C(O)C4O)C=CC=C32)C1O[Si](C)(C)C(C)(C)C	5542.4	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C(O)C1O	5509.8	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1O	5548.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C1O	5520.7	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	5538.8	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1O	5588.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OC1C(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	5603.4	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C1O[Si](C)(C)C(C)(C)C	5573.9	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C(O)C1O	5497.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	5497.5	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	5563.1	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	5542.0	Semi standard non polar	33892256
Rheinoside C,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(OC2=CC=CC3=C2C(=O)C2=C(O)C=C(C(=O)O)C=C2C3C2OC(CO)C(O)C(O)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	5547.2	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 - Rheinoside C GC-MS (Non-derivatized) - 70eV, Positive	splash10-01si-1200390000-09de21d54243d2d05577	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (1 TMS) - 70eV, Positive	splash10-0uds-3400049000-3996051455dc252130a6	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS ("Rheinoside C,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Rheinoside C GC-MS (TMS_2_13) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 10V, Positive-QTOF	splash10-00pj-0001890000-e6c6735e51164d232c76	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 20V, Positive-QTOF	splash10-014i-0113920000-03adc8fe124c91442cc4	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 40V, Positive-QTOF	splash10-015i-1249720000-75dda2fab2b9621d69a7	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 10V, Negative-QTOF	splash10-002f-0101590000-8e2bb90ed2bdb0c50f53	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 20V, Negative-QTOF	splash10-01q9-1204970000-347f587bc0dc6fa4511a	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 40V, Negative-QTOF	splash10-01pp-5119600000-2208262515eeffc4c865	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 10V, Positive-QTOF	splash10-00kb-0100790000-09e1ac1204a7f6e986d1	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 20V, Positive-QTOF	splash10-010r-1110890000-b4855e4a8408c9cf5daa	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 40V, Positive-QTOF	splash10-05aj-8710920000-e911eeb5d14dd9c3b6d8	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 10V, Negative-QTOF	splash10-0006-0001960000-8a6779d35b4d61c8056d	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 20V, Negative-QTOF	splash10-0a5c-2001940000-59a0a15f7c6742a39028	2021-09-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Rheinoside C 40V, Negative-QTOF	splash10-0ac3-9354600000-83826d435e22332a49b0	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)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

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

FDB020652

KNApSAcK ID

Not Available

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

13888128

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

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

Showing metabocard for Rheinoside C (HMDB0040831)

MOL for HMDB0040831 (Rheinoside C)

3D MOL for HMDB0040831 (Rheinoside C)

3D SDF for HMDB0040831 (Rheinoside C)

3D-SDF for HMDB0040831 (Rheinoside C)

PDB for HMDB0040831 (Rheinoside C)

3D PDB for HMDB0040831 (Rheinoside C)

SMILES for HMDB0040831 (Rheinoside C)

INCHI for HMDB0040831 (Rheinoside C)

Structure for HMDB0040831 (Rheinoside C)

3D Structure for HMDB0040831 (Rheinoside C)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra