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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-11 22:02:10 UTC

Update Date

2022-03-07 02:55:05 UTC

HMDB ID

HMDB0036856

Secondary Accession Numbers

HMDB36856

Metabolite Identification

Common Name

19-Hydroxycinnzeylanol 19-glucoside

Description

19-Hydroxycinnzeylanol 19-glucoside belongs to the class of organic compounds known as diterpene glycosides. These are diterpenoids in which an isoprene unit is glycosylated. Based on a literature review a small amount of articles have been published on 19-Hydroxycinnzeylanol 19-glucoside.

Structure

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

  Mrv0541 09111222022D          

 39 44  0  0  0  0            999 V2000
    0.7008    2.6665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3409    2.1790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4017    1.3562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1333    1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0664   -2.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6704   -1.9960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1217   -2.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8531   -1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4628   -1.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6761   -2.1179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4628   -2.4836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0002   -1.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6704   -0.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1275   -1.2952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8588   -0.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8284   -0.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6512   -0.3200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7008    2.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0303    2.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0303    1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8531    1.3562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5598    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7369    0.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0664   -0.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1217   -0.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7008   -0.3200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5789    0.7161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0361    0.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6399    0.9599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1828    0.5638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7980   -1.8438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6761   -1.4474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0722   -1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -1.1122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6512   -1.1122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6512   -1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -1.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0722   -2.1179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -2.4836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  3 29  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 32  1  0  0  0  0
 10 11  1  0  0  0  0
 10 38  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 25  1  0  0  0  0
 13 28  1  0  0  0  0
 14 15  1  0  0  0  0
 14 31  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 23  1  0  0  0  0
 16 28  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 29  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
 25 26  1  0  0  0  0
 25 30  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 37  1  0  0  0  0
 34 35  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
M  END

HMDB0036856
     RDKit          3D
19-Hydroxycinnzeylanol 19-glucoside
 81 86  0  0  0  0  0  0  0  0999 V2000
   -4.6800   -0.5736   -3.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3711   -0.8861   -1.9456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0291    0.3447   -1.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9262    1.2627   -0.8787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2203    0.5835    0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1068    0.4831    1.3138 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9922    1.2855    0.7362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1687    2.7375    0.9743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6203    0.5160    2.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030   -0.9199    1.7273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0631   -1.6254    2.8437 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5935   -1.4299    1.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6757   -0.7717   -0.0926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5007   -1.6085   -0.9841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3211   -2.4720   -0.2207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2694   -0.5357   -0.5422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9765   -0.8394   -1.8078 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9463    0.9369   -0.2858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209    1.6946   -1.4381 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5511    0.9543    0.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210   -0.4284    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0232   -0.3866    2.1536 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0111   -0.9848    0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0049   -1.1252   -1.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1924   -0.0696    0.4894 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2897   -0.6316   -0.1004 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4917    0.0664    0.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3907   -0.6236    0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5465    0.0679    1.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2515    1.3827    1.7774 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4716    2.0556    2.0673 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3266    0.3731   -0.1708 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4673   -0.4113   -0.2925 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4527    0.0913   -1.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9750    0.7852   -2.4792 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0485    0.5984   -1.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3277    0.2009   -2.3006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4632   -1.1848    0.5454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3425   -2.6622    0.4245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0400    0.3113   -3.2162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.3026   -3.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1554   -1.4699   -3.6212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2146   -1.5862   -2.2231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6127    0.0394   -0.4939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6420    0.8053   -2.1563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4679    2.1512   -0.4387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3382    1.6480   -1.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5241    1.3716    1.4308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9639    3.2825    0.0275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086    3.0596    1.7389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1929    2.9292    1.3494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5617    0.5781    2.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8547    1.0273    2.5853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7742   -2.2665    3.0869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8338   -2.2906   -1.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8299   -3.0671   -0.8215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9377   -1.7561   -2.1004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5768    1.2559   -2.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1254    1.2789   -0.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4270    1.7250    1.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4590    0.4321    2.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2611   -1.9466    0.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4902   -2.0417   -1.7042 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6935   -0.2018   -1.8295 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0826   -1.2784   -1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2578    0.0028    1.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0493    0.9430    0.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1582    0.9440    0.7293 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2516   -0.5328    1.7272 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7197    2.1013    1.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6529    1.2923    2.6872 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2080    2.7579    2.7362 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6468    1.4282   -0.2394 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2013   -0.1243    0.2923 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4986   -0.9717   -1.6054 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9636    0.6374   -2.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0130    1.7147   -1.1461 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3296   -0.7916   -2.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4003   -3.0472   -0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1771   -3.2089    0.9593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4174   -3.0831    0.8512 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 29 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 21 38  1  0
 38 39  1  0
 14  2  1  0
 38 16  1  0
 13  5  1  0
 36 27  1  0
 18  7  1  0
 38 10  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  3 44  1  0
  3 45  1  0
  4 46  1  0
  4 47  1  0
  6 48  1  0
  8 49  1  0
  8 50  1  0
  8 51  1  0
  9 52  1  0
  9 53  1  0
 11 54  1  0
 14 55  1  0
 15 56  1  0
 17 57  1  0
 19 58  1  0
 20 59  1  0
 20 60  1  0
 22 61  1  0
 23 62  1  0
 24 63  1  0
 24 64  1  0
 24 65  1  0
 25 66  1  0
 25 67  1  0
 27 68  1  0
 29 69  1  0
 30 70  1  0
 30 71  1  0
 31 72  1  0
 32 73  1  0
 33 74  1  0
 34 75  1  0
 35 76  1  0
 36 77  1  0
 37 78  1  0
 39 79  1  0
 39 80  1  0
 39 81  1  0
M  END

  Mrv0541 09111222022D          

 39 44  0  0  0  0            999 V2000
    0.7008    2.6665    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3409    2.1790    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4017    1.3562    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1333    1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0664   -2.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6704   -1.9960    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1217   -2.2094    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8531   -1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4628   -1.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6761   -2.1179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4628   -2.4836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0002   -1.0818    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6704   -0.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1275   -1.2952    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8588   -0.9292    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8284   -0.1067    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6512   -0.3200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7008    2.7580    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0303    2.3009    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0303    1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8531    1.3562    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.5598    0.7466    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7369    0.5942    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0664   -0.1982    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1217   -0.1678    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7008   -0.3200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.5789    0.7161    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0361    0.1979    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6399    0.9599    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1828    0.5638    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.7980   -1.8438    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6761   -1.4474    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0722   -1.4474    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -1.1122    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6512   -1.1122    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6512   -1.7827    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -1.7827    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0722   -2.1179    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2551   -2.4836    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 19  1  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3 23  1  0  0  0  0
  3 29  1  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  6 14  1  0  0  0  0
  7  8  1  0  0  0  0
  8  9  1  0  0  0  0
  9 10  1  0  0  0  0
  9 32  1  0  0  0  0
 10 11  1  0  0  0  0
 10 38  1  0  0  0  0
 12 13  1  0  0  0  0
 13 14  1  0  0  0  0
 13 25  1  0  0  0  0
 13 28  1  0  0  0  0
 14 15  1  0  0  0  0
 14 31  1  0  0  0  0
 15 16  1  0  0  0  0
 16 17  1  0  0  0  0
 16 23  1  0  0  0  0
 16 28  1  0  0  0  0
 18 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 20 29  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
 25 26  1  0  0  0  0
 25 30  1  0  0  0  0
 27 28  1  0  0  0  0
 28 29  1  0  0  0  0
 29 30  1  0  0  0  0
 32 33  1  0  0  0  0
 33 34  1  0  0  0  0
 33 37  1  0  0  0  0
 34 35  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
M  END
> <DATABASE_ID>
HMDB0036856

> <DATABASE_NAME>
hmdb

> <SMILES>
CC(COC1OC(CO)C(O)C(O)C1O)C1(O)CC2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C

> <INCHI_IDENTIFIER>
InChI=1S/C26H42O13/c1-11-5-6-22(33)19(3)9-24(35)20(4)21(32,10-23(19,34)26(20,36)25(22,39-24)17(11)31)12(2)8-37-18-16(30)15(29)14(28)13(7-27)38-18/h11-18,27-36H,5-10H2,1-4H3

> <INCHI_KEY>
JDXUGCGESVBRHW-UHFFFAOYSA-N

> <FORMULA>
C26H42O13

> <MOLECULAR_WEIGHT>
562.6039

> <EXACT_MASS>
562.26254143

> <JCHEM_ACCEPTOR_COUNT>
13

> <JCHEM_AVERAGE_POLARIZABILITY>
56.503749550215915

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3,7,10-trimethyl-11-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-15-oxapentacyclo[7.5.1.0¹,⁶.0⁷,¹³.0¹⁰,¹⁴]pentadecane-2,6,9,11,13,14-hexol

> <ALOGPS_LOGP>
-1.63

> <JCHEM_LOGP>
-3.8689958316666684

> <ALOGPS_LOGS>
-1.19

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
6

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
11.911130939121314

> <JCHEM_PKA_STRONGEST_ACIDIC>
11.267146080148626

> <JCHEM_PKA_STRONGEST_BASIC>
-3.4099959239788724

> <JCHEM_POLAR_SURFACE_AREA>
229.98999999999995

> <JCHEM_REFRACTIVITY>
127.75069999999998

> <JCHEM_ROTATABLE_BOND_COUNT>
5

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.60e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
3,7,10-trimethyl-11-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-15-oxapentacyclo[7.5.1.0¹,⁶.0⁷,¹³.0¹⁰,¹⁴]pentadecane-2,6,9,11,13,14-hexol

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0036856
     RDKit          3D
19-Hydroxycinnzeylanol 19-glucoside
 81 86  0  0  0  0  0  0  0  0999 V2000
   -4.6800   -0.5736   -3.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3711   -0.8861   -1.9456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0291    0.3447   -1.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9262    1.2627   -0.8787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2203    0.5835    0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1068    0.4831    1.3138 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9922    1.2855    0.7362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1687    2.7375    0.9743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6203    0.5160    2.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030   -0.9199    1.7273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0631   -1.6254    2.8437 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5935   -1.4299    1.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6757   -0.7717   -0.0926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5007   -1.6085   -0.9841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3211   -2.4720   -0.2207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2694   -0.5357   -0.5422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9765   -0.8394   -1.8078 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9463    0.9369   -0.2858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209    1.6946   -1.4381 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5511    0.9543    0.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210   -0.4284    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0232   -0.3866    2.1536 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0111   -0.9848    0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0049   -1.1252   -1.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1924   -0.0696    0.4894 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2897   -0.6316   -0.1004 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4917    0.0664    0.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3907   -0.6236    0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5465    0.0679    1.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2515    1.3827    1.7774 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4716    2.0556    2.0673 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3266    0.3731   -0.1708 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4673   -0.4113   -0.2925 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4527    0.0913   -1.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9750    0.7852   -2.4792 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0485    0.5984   -1.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3277    0.2009   -2.3006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4632   -1.1848    0.5454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3425   -2.6622    0.4245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0400    0.3113   -3.2162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.3026   -3.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1554   -1.4699   -3.6212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2146   -1.5862   -2.2231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6127    0.0394   -0.4939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6420    0.8053   -2.1563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4679    2.1512   -0.4387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3382    1.6480   -1.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5241    1.3716    1.4308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9639    3.2825    0.0275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086    3.0596    1.7389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1929    2.9292    1.3494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5617    0.5781    2.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8547    1.0273    2.5853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7742   -2.2665    3.0869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8338   -2.2906   -1.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8299   -3.0671   -0.8215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9377   -1.7561   -2.1004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5768    1.2559   -2.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1254    1.2789   -0.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4270    1.7250    1.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4590    0.4321    2.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2611   -1.9466    0.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4902   -2.0417   -1.7042 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6935   -0.2018   -1.8295 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0826   -1.2784   -1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2578    0.0028    1.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0493    0.9430    0.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1582    0.9440    0.7293 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2516   -0.5328    1.7272 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7197    2.1013    1.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6529    1.2923    2.6872 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2080    2.7579    2.7362 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6468    1.4282   -0.2394 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2013   -0.1243    0.2923 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4986   -0.9717   -1.6054 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9636    0.6374   -2.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0130    1.7147   -1.1461 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3296   -0.7916   -2.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4003   -3.0472   -0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1771   -3.2089    0.9593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4174   -3.0831    0.8512 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 29 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 21 38  1  0
 38 39  1  0
 14  2  1  0
 38 16  1  0
 13  5  1  0
 36 27  1  0
 18  7  1  0
 38 10  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  3 44  1  0
  3 45  1  0
  4 46  1  0
  4 47  1  0
  6 48  1  0
  8 49  1  0
  8 50  1  0
  8 51  1  0
  9 52  1  0
  9 53  1  0
 11 54  1  0
 14 55  1  0
 15 56  1  0
 17 57  1  0
 19 58  1  0
 20 59  1  0
 20 60  1  0
 22 61  1  0
 23 62  1  0
 24 63  1  0
 24 64  1  0
 24 65  1  0
 25 66  1  0
 25 67  1  0
 27 68  1  0
 29 69  1  0
 30 70  1  0
 30 71  1  0
 31 72  1  0
 32 73  1  0
 33 74  1  0
 34 75  1  0
 35 76  1  0
 36 77  1  0
 37 78  1  0
 39 79  1  0
 39 80  1  0
 39 81  1  0
M  END

HEADER    PROTEIN                                 11-SEP-12   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   11-SEP-12         0                                  
HETATM    1  C   UNK     0       1.308   4.977   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0       2.503   4.067   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.617   2.532   0.000  0.00  0.00           C+0
HETATM    4  O   UNK     0       3.982   3.328   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0       1.991  -5.148   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0       1.251  -3.726   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -0.227  -4.124   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0      -1.592  -3.328   0.000  0.00  0.00           O+0
HETATM    9  C   UNK     0      -2.731  -3.328   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0      -3.129  -3.953   0.000  0.00  0.00           C+0
HETATM   11  O   UNK     0      -2.731  -4.636   0.000  0.00  0.00           O+0
HETATM   12  C   UNK     0      -0.000  -2.019   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0       1.251  -1.109   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0       2.105  -2.418   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0       3.470  -1.735   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0       3.413  -0.199   0.000  0.00  0.00           C+0
HETATM   17  O   UNK     0       4.949  -0.597   0.000  0.00  0.00           O+0
HETATM   18  C   UNK     0      -1.308   5.148   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -0.057   4.295   0.000  0.00  0.00           C+0
HETATM   20  C   UNK     0      -0.057   2.702   0.000  0.00  0.00           C+0
HETATM   21  O   UNK     0      -1.592   2.532   0.000  0.00  0.00           O+0
HETATM   22  C   UNK     0       4.778   1.394   0.000  0.00  0.00           C+0
HETATM   23  C   UNK     0       3.242   1.109   0.000  0.00  0.00           C+0
HETATM   24  C   UNK     0       1.991  -0.370   0.000  0.00  0.00           C+0
HETATM   25  C   UNK     0       0.227  -0.313   0.000  0.00  0.00           C+0
HETATM   26  O   UNK     0      -1.308  -0.597   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0       1.081   1.337   0.000  0.00  0.00           O+0
HETATM   28  C   UNK     0       1.934   0.369   0.000  0.00  0.00           C+0
HETATM   29  C   UNK     0       1.194   1.792   0.000  0.00  0.00           C+0
HETATM   30  O   UNK     0      -0.341   1.052   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       3.356  -3.442   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      -3.129  -2.702   0.000  0.00  0.00           O+0
HETATM   33  C   UNK     0      -3.868  -2.702   0.000  0.00  0.00           C+0
HETATM   34  C   UNK     0      -4.210  -2.076   0.000  0.00  0.00           C+0
HETATM   35  O   UNK     0      -4.949  -2.076   0.000  0.00  0.00           O+0
HETATM   36  O   UNK     0      -4.949  -3.328   0.000  0.00  0.00           O+0
HETATM   37  C   UNK     0      -4.210  -3.328   0.000  0.00  0.00           C+0
HETATM   38  C   UNK     0      -3.868  -3.953   0.000  0.00  0.00           C+0
HETATM   39  O   UNK     0      -4.210  -4.636   0.000  0.00  0.00           O+0
CONECT    1    2   19                                                       
CONECT    2    1    3                                                       
CONECT    3    2    4   23   29                                             
CONECT    4    3                                                            
CONECT    5    6                                                            
CONECT    6    5    7   14                                                  
CONECT    7    6    8                                                       
CONECT    8    7    9                                                       
CONECT    9    8   10   32                                                  
CONECT   10    9   11   38                                                  
CONECT   11   10                                                            
CONECT   12   13                                                            
CONECT   13   12   14   25   28                                             
CONECT   14    6   13   15   31                                             
CONECT   15   14   16                                                       
CONECT   16   15   17   23   28                                             
CONECT   17   16                                                            
CONECT   18   19                                                            
CONECT   19    1   18   20                                                  
CONECT   20   19   21   29                                                  
CONECT   21   20                                                            
CONECT   22   23                                                            
CONECT   23    3   16   22   24                                             
CONECT   24   23   25                                                       
CONECT   25   13   24   26   30                                             
CONECT   26   25                                                            
CONECT   27   28                                                            
CONECT   28   13   16   27   29                                             
CONECT   29    3   20   28   30                                             
CONECT   30   25   29                                                       
CONECT   31   14                                                            
CONECT   32    9   33                                                       
CONECT   33   32   34   37                                                  
CONECT   34   33   35                                                       
CONECT   35   34                                                            
CONECT   36   37                                                            
CONECT   37   33   36   38                                                  
CONECT   38   10   37   39                                                  
CONECT   39   38                                                            
MASTER        0    0    0    0    0    0    0    0   39    0   88    0
END

COMPND    HMDB0036856
HETATM    1  C1  UNL     1      -4.680  -0.574  -3.268  1.00  0.00           C  
HETATM    2  C2  UNL     1      -5.371  -0.886  -1.946  1.00  0.00           C  
HETATM    3  C3  UNL     1      -6.029   0.345  -1.380  1.00  0.00           C  
HETATM    4  C4  UNL     1      -4.926   1.263  -0.879  1.00  0.00           C  
HETATM    5  C5  UNL     1      -4.220   0.583   0.216  1.00  0.00           C  
HETATM    6  O1  UNL     1      -5.107   0.483   1.314  1.00  0.00           O  
HETATM    7  C6  UNL     1      -2.992   1.286   0.736  1.00  0.00           C  
HETATM    8  C7  UNL     1      -3.169   2.738   0.974  1.00  0.00           C  
HETATM    9  C8  UNL     1      -2.620   0.516   2.012  1.00  0.00           C  
HETATM   10  C9  UNL     1      -2.403  -0.920   1.727  1.00  0.00           C  
HETATM   11  O2  UNL     1      -2.063  -1.625   2.844  1.00  0.00           O  
HETATM   12  O3  UNL     1      -3.594  -1.430   1.159  1.00  0.00           O  
HETATM   13  C10 UNL     1      -3.676  -0.772  -0.093  1.00  0.00           C  
HETATM   14  C11 UNL     1      -4.501  -1.608  -0.984  1.00  0.00           C  
HETATM   15  O4  UNL     1      -5.321  -2.472  -0.221  1.00  0.00           O  
HETATM   16  C12 UNL     1      -2.269  -0.536  -0.542  1.00  0.00           C  
HETATM   17  O5  UNL     1      -1.977  -0.839  -1.808  1.00  0.00           O  
HETATM   18  C13 UNL     1      -1.946   0.937  -0.286  1.00  0.00           C  
HETATM   19  O6  UNL     1      -2.021   1.695  -1.438  1.00  0.00           O  
HETATM   20  C14 UNL     1      -0.551   0.954   0.270  1.00  0.00           C  
HETATM   21  C15 UNL     1      -0.221  -0.428   0.758  1.00  0.00           C  
HETATM   22  O7  UNL     1       0.023  -0.387   2.154  1.00  0.00           O  
HETATM   23  C16 UNL     1       1.011  -0.985   0.146  1.00  0.00           C  
HETATM   24  C17 UNL     1       1.005  -1.125  -1.338  1.00  0.00           C  
HETATM   25  C18 UNL     1       2.192  -0.070   0.489  1.00  0.00           C  
HETATM   26  O8  UNL     1       3.290  -0.632  -0.100  1.00  0.00           O  
HETATM   27  C19 UNL     1       4.492   0.066   0.096  1.00  0.00           C  
HETATM   28  O9  UNL     1       5.391  -0.624   0.829  1.00  0.00           O  
HETATM   29  C20 UNL     1       6.547   0.068   1.101  1.00  0.00           C  
HETATM   30  C21 UNL     1       6.251   1.383   1.777  1.00  0.00           C  
HETATM   31  O10 UNL     1       7.472   2.056   2.067  1.00  0.00           O  
HETATM   32  C22 UNL     1       7.327   0.373  -0.171  1.00  0.00           C  
HETATM   33  O11 UNL     1       8.467  -0.411  -0.293  1.00  0.00           O  
HETATM   34  C23 UNL     1       6.453   0.091  -1.383  1.00  0.00           C  
HETATM   35  O12 UNL     1       6.975   0.785  -2.479  1.00  0.00           O  
HETATM   36  C24 UNL     1       5.048   0.598  -1.168  1.00  0.00           C  
HETATM   37  O13 UNL     1       4.328   0.201  -2.301  1.00  0.00           O  
HETATM   38  C25 UNL     1      -1.463  -1.185   0.545  1.00  0.00           C  
HETATM   39  C26 UNL     1      -1.342  -2.662   0.425  1.00  0.00           C  
HETATM   40  H1  UNL     1      -4.040   0.311  -3.216  1.00  0.00           H  
HETATM   41  H2  UNL     1      -5.519  -0.303  -3.973  1.00  0.00           H  
HETATM   42  H3  UNL     1      -4.155  -1.470  -3.621  1.00  0.00           H  
HETATM   43  H4  UNL     1      -6.215  -1.586  -2.223  1.00  0.00           H  
HETATM   44  H5  UNL     1      -6.613   0.039  -0.494  1.00  0.00           H  
HETATM   45  H6  UNL     1      -6.642   0.805  -2.156  1.00  0.00           H  
HETATM   46  H7  UNL     1      -5.468   2.151  -0.439  1.00  0.00           H  
HETATM   47  H8  UNL     1      -4.338   1.648  -1.705  1.00  0.00           H  
HETATM   48  H9  UNL     1      -5.524   1.372   1.431  1.00  0.00           H  
HETATM   49  H10 UNL     1      -2.964   3.282   0.028  1.00  0.00           H  
HETATM   50  H11 UNL     1      -2.409   3.060   1.739  1.00  0.00           H  
HETATM   51  H12 UNL     1      -4.193   2.929   1.349  1.00  0.00           H  
HETATM   52  H13 UNL     1      -3.562   0.578   2.638  1.00  0.00           H  
HETATM   53  H14 UNL     1      -1.855   1.027   2.585  1.00  0.00           H  
HETATM   54  H15 UNL     1      -2.774  -2.266   3.087  1.00  0.00           H  
HETATM   55  H16 UNL     1      -3.834  -2.291  -1.577  1.00  0.00           H  
HETATM   56  H17 UNL     1      -5.830  -3.067  -0.822  1.00  0.00           H  
HETATM   57  H18 UNL     1      -1.938  -1.756  -2.100  1.00  0.00           H  
HETATM   58  H19 UNL     1      -1.577   1.256  -2.186  1.00  0.00           H  
HETATM   59  H20 UNL     1       0.125   1.279  -0.547  1.00  0.00           H  
HETATM   60  H21 UNL     1      -0.427   1.725   1.076  1.00  0.00           H  
HETATM   61  H22 UNL     1       0.459   0.432   2.437  1.00  0.00           H  
HETATM   62  H23 UNL     1       1.261  -1.947   0.639  1.00  0.00           H  
HETATM   63  H24 UNL     1       0.490  -2.042  -1.704  1.00  0.00           H  
HETATM   64  H25 UNL     1       0.693  -0.202  -1.830  1.00  0.00           H  
HETATM   65  H26 UNL     1       2.083  -1.278  -1.648  1.00  0.00           H  
HETATM   66  H27 UNL     1       2.258   0.003   1.593  1.00  0.00           H  
HETATM   67  H28 UNL     1       2.049   0.943   0.105  1.00  0.00           H  
HETATM   68  H29 UNL     1       4.158   0.944   0.729  1.00  0.00           H  
HETATM   69  H30 UNL     1       7.252  -0.533   1.727  1.00  0.00           H  
HETATM   70  H31 UNL     1       5.720   2.101   1.101  1.00  0.00           H  
HETATM   71  H32 UNL     1       5.653   1.292   2.687  1.00  0.00           H  
HETATM   72  H33 UNL     1       7.208   2.758   2.736  1.00  0.00           H  
HETATM   73  H34 UNL     1       7.647   1.428  -0.239  1.00  0.00           H  
HETATM   74  H35 UNL     1       9.201  -0.124   0.292  1.00  0.00           H  
HETATM   75  H36 UNL     1       6.499  -0.972  -1.605  1.00  0.00           H  
HETATM   76  H37 UNL     1       7.964   0.637  -2.440  1.00  0.00           H  
HETATM   77  H38 UNL     1       5.013   1.715  -1.146  1.00  0.00           H  
HETATM   78  H39 UNL     1       4.330  -0.792  -2.393  1.00  0.00           H  
HETATM   79  H40 UNL     1      -1.400  -3.047  -0.620  1.00  0.00           H  
HETATM   80  H41 UNL     1      -2.177  -3.209   0.959  1.00  0.00           H  
HETATM   81  H42 UNL     1      -0.417  -3.083   0.851  1.00  0.00           H  
CONECT    1    2   40   41   42
CONECT    2    3   14   43
CONECT    3    4   44   45
CONECT    4    5   46   47
CONECT    5    6    7   13
CONECT    6   48
CONECT    7    8    9   18
CONECT    8   49   50   51
CONECT    9   10   52   53
CONECT   10   11   12   38
CONECT   11   54
CONECT   12   13
CONECT   13   14   16
CONECT   14   15   55
CONECT   15   56
CONECT   16   17   18   38
CONECT   17   57
CONECT   18   19   20
CONECT   19   58
CONECT   20   21   59   60
CONECT   21   22   23   38
CONECT   22   61
CONECT   23   24   25   62
CONECT   24   63   64   65
CONECT   25   26   66   67
CONECT   26   27
CONECT   27   28   36   68
CONECT   28   29
CONECT   29   30   32   69
CONECT   30   31   70   71
CONECT   31   72
CONECT   32   33   34   73
CONECT   33   74
CONECT   34   35   36   75
CONECT   35   76
CONECT   36   37   77
CONECT   37   78
CONECT   38   39
CONECT   39   79   80   81
END

HMDB0036856
     RDKit          3D
19-Hydroxycinnzeylanol 19-glucoside
 81 86  0  0  0  0  0  0  0  0999 V2000
   -4.6800   -0.5736   -3.2675 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3711   -0.8861   -1.9456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0291    0.3447   -1.3802 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9262    1.2627   -0.8787 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2203    0.5835    0.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1068    0.4831    1.3138 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9922    1.2855    0.7362 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1687    2.7375    0.9743 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6203    0.5160    2.0124 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4030   -0.9199    1.7273 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0631   -1.6254    2.8437 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5935   -1.4299    1.1586 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6757   -0.7717   -0.0926 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5007   -1.6085   -0.9841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3211   -2.4720   -0.2207 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2694   -0.5357   -0.5422 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9765   -0.8394   -1.8078 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9463    0.9369   -0.2858 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0209    1.6946   -1.4381 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5511    0.9543    0.2698 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2210   -0.4284    0.7583 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0232   -0.3866    2.1536 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0111   -0.9848    0.1460 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0049   -1.1252   -1.3378 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1924   -0.0696    0.4894 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2897   -0.6316   -0.1004 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.4917    0.0664    0.0958 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.3907   -0.6236    0.8289 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.5465    0.0679    1.1010 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2515    1.3827    1.7774 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4716    2.0556    2.0673 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.3266    0.3731   -0.1708 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4673   -0.4113   -0.2925 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.4527    0.0913   -1.3827 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.9750    0.7852   -2.4792 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0485    0.5984   -1.1681 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3277    0.2009   -2.3006 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4632   -1.1848    0.5454 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3425   -2.6622    0.4245 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0400    0.3113   -3.2162 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5194   -0.3026   -3.9728 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1554   -1.4699   -3.6212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2146   -1.5862   -2.2231 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6127    0.0394   -0.4939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6420    0.8053   -2.1563 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4679    2.1512   -0.4387 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3382    1.6480   -1.7045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5241    1.3716    1.4308 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9639    3.2825    0.0275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4086    3.0596    1.7389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1929    2.9292    1.3494 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5617    0.5781    2.6382 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8547    1.0273    2.5853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7742   -2.2665    3.0869 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8338   -2.2906   -1.5768 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8299   -3.0671   -0.8215 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9377   -1.7561   -2.1004 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5768    1.2559   -2.1861 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1254    1.2789   -0.5472 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4270    1.7250    1.0761 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4590    0.4321    2.4374 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2611   -1.9466    0.6389 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4902   -2.0417   -1.7042 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6935   -0.2018   -1.8295 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0826   -1.2784   -1.6479 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2578    0.0028    1.5928 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0493    0.9430    0.1048 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1582    0.9440    0.7293 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2516   -0.5328    1.7272 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7197    2.1013    1.1010 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6529    1.2923    2.6872 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.2080    2.7579    2.7362 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6468    1.4282   -0.2394 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.2013   -0.1243    0.2923 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4986   -0.9717   -1.6054 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9636    0.6374   -2.4400 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0130    1.7147   -1.1461 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3296   -0.7916   -2.3935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4003   -3.0472   -0.6200 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1771   -3.2089    0.9593 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4174   -3.0831    0.8512 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  5  7  1  0
  7  8  1  0
  7  9  1  0
  9 10  1  0
 10 11  1  0
 10 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 13 16  1  0
 16 17  1  0
 16 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 21 22  1  0
 21 23  1  0
 23 24  1  0
 23 25  1  0
 25 26  1  0
 26 27  1  0
 27 28  1  0
 28 29  1  0
 29 30  1  0
 30 31  1  0
 29 32  1  0
 32 33  1  0
 32 34  1  0
 34 35  1  0
 34 36  1  0
 36 37  1  0
 21 38  1  0
 38 39  1  0
 14  2  1  0
 38 16  1  0
 13  5  1  0
 36 27  1  0
 18  7  1  0
 38 10  1  0
  1 40  1  0
  1 41  1  0
  1 42  1  0
  2 43  1  0
  3 44  1  0
  3 45  1  0
  4 46  1  0
  4 47  1  0
  6 48  1  0
  8 49  1  0
  8 50  1  0
  8 51  1  0
  9 52  1  0
  9 53  1  0
 11 54  1  0
 14 55  1  0
 15 56  1  0
 17 57  1  0
 19 58  1  0
 20 59  1  0
 20 60  1  0
 22 61  1  0
 23 62  1  0
 24 63  1  0
 24 64  1  0
 24 65  1  0
 25 66  1  0
 25 67  1  0
 27 68  1  0
 29 69  1  0
 30 70  1  0
 30 71  1  0
 31 72  1  0
 32 73  1  0
 33 74  1  0
 34 75  1  0
 35 76  1  0
 36 77  1  0
 37 78  1  0
 39 79  1  0
 39 80  1  0
 39 81  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Not Available

Chemical Formula

C₂₆H₄₂O₁₃

Average Molecular Weight

562.6039

Monoisotopic Molecular Weight

562.26254143

IUPAC Name

3,7,10-trimethyl-11-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-15-oxapentacyclo[7.5.1.0¹,⁶.0⁷,¹³.0¹⁰,¹⁴]pentadecane-2,6,9,11,13,14-hexol

Traditional Name

3,7,10-trimethyl-11-(1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}propan-2-yl)-15-oxapentacyclo[7.5.1.0¹,⁶.0⁷,¹³.0¹⁰,¹⁴]pentadecane-2,6,9,11,13,14-hexol

CAS Registry Number

Not Available

SMILES

CC(COC1OC(CO)C(O)C(O)C1O)C1(O)CC2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C

InChI Identifier

InChI=1S/C26H42O13/c1-11-5-6-22(33)19(3)9-24(35)20(4)21(32,10-23(19,34)26(20,36)25(22,39-24)17(11)31)12(2)8-37-18-16(30)15(29)14(28)13(7-27)38-18/h11-18,27-36H,5-10H2,1-4H3

InChI Key

JDXUGCGESVBRHW-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as diterpene glycosides. These are diterpenoids in which an isoprene unit is glycosylated.

Kingdom

Organic compounds

Super Class

Lipids and lipid-like molecules

Class

Prenol lipids

Sub Class

Terpene glycosides

Direct Parent

Diterpene glycosides

Alternative Parents

Substituents

Diterpene glycoside
Diterpenoid
Ryanodane diterpenoid
Hexose monosaccharide
Glycosyl compound
O-glycosyl compound
Oxepane
Monosaccharide
Oxane
Cyclic alcohol
Tetrahydrofuran
Tertiary alcohol
Secondary alcohol
Hemiacetal
Organoheterocyclic compound
Oxacycle
Acetal
Polyol
Alcohol
Hydrocarbon derivative
Organic oxygen compound
Organooxygen compound
Primary alcohol
Aliphatic heteropolycyclic compound

Molecular Framework

Aliphatic heteropolycyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Source

Exogenous

Exogenous (HMDB: HMDB0036856)

Food

Herb and spice

Herbs and Spices (FooDB: FOOD00866)

Endogenous

Endogenous (HMDB: HMDB0036856)

Process

Not Available

Role

Not Available

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	36 g/L	ALOGPS
logP	-1.6	ALOGPS
logP	-3.9	ChemAxon
logS	-1.2	ALOGPS
pKa (Strongest Acidic)	11.27	ChemAxon
pKa (Strongest Basic)	-3.4	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	13	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	229.99 Å²	ChemAxon
Rotatable Bond Count	5	ChemAxon
Refractivity	127.75 m³·mol⁻¹	ChemAxon
Polarizability	56.5 Å³	ChemAxon
Number of Rings	6	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	221.763	31661259
DarkChem	[M-H]-	213.626	31661259
DeepCCS	[M-2H]-	255.98	30932474
DeepCCS	[M+Na]+	231.405	30932474
AllCCS	[M+H]+	226.0	32859911
AllCCS	[M+H-H2O]+	224.8	32859911
AllCCS	[M+NH4]+	227.0	32859911
AllCCS	[M+Na]+	227.3	32859911
AllCCS	[M-H]-	228.0	32859911
AllCCS	[M+Na-2H]-	229.5	32859911
AllCCS	[M+HCOO]-	231.2	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
19-Hydroxycinnzeylanol 19-glucoside	CC(COC1OC(CO)C(O)C(O)C1O)C1(O)CC2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C	3617.9	Standard polar	33892256
19-Hydroxycinnzeylanol 19-glucoside	CC(COC1OC(CO)C(O)C(O)C1O)C1(O)CC2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C	3813.3	Standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside	CC(COC1OC(CO)C(O)C(O)C1O)C1(O)CC2(O)C3(C)CC4(O)OC5(C(O)C(C)CCC35O)C2(O)C14C	4383.6	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #1	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4449.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #10	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4461.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #2	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4459.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #3	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4446.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #4	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4429.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #5	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4457.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #6	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4470.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #7	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4489.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #8	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4471.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TMS,isomer #9	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4462.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #1	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4334.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #10	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4345.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #11	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4371.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #12	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4360.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #13	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4343.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #14	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4356.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #15	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4345.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #16	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4341.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #17	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4334.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #18	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4322.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #19	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4354.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #2	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4365.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #20	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4340.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #21	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4327.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #22	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4334.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #23	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4324.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #24	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4347.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #25	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4315.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #26	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4339.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #27	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4332.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #28	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4314.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #29	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4324.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #3	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4354.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #30	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4313.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #31	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4346.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #32	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4367.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #33	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4352.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #34	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4342.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #35	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4354.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #36	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4363.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #37	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4390.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #38	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4371.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #39	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4377.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #4	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4337.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #40	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4386.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #41	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4383.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #42	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4376.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #43	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4368.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #44	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4359.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #45	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4368.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #5	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4345.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #6	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4334.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #7	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4351.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #8	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4341.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TMS,isomer #9	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4337.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #1	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4244.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #10	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4238.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #100	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4192.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #101	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4248.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #102	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4229.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #103	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4235.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #104	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4229.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #105	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4255.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #106	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4249.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #107	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4249.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #108	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4231.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #109	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4239.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #11	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4249.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #110	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4242.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #111	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4261.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #112	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4252.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #113	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4262.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #114	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4272.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #115	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4269.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #116	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4269.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #117	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4271.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #118	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4260.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #119	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4260.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #12	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4232.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #120	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4259.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #13	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4237.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #14	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4229.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #15	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4225.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #16	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4222.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #17	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4231.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #18	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4220.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #19	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4230.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #2	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4227.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #20	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4217.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #21	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4215.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #22	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4238.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #23	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4210.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #24	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4217.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #25	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4205.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #26	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4205.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #27	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4216.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #28	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4223.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #29	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4210.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #3	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4226.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #30	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4212.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #31	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4216.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #32	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4206.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #33	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4203.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #34	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4236.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #35	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4234.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #36	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4243.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #37	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4242.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #38	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4230.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #39	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4230.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #4	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4222.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #40	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4227.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #41	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4205.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #42	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4194.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #43	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4191.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #44	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4248.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #45	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4239.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #46	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4249.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #47	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4232.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #48	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4226.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #49	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4219.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #5	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4203.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #50	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4226.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #51	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4235.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #52	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4224.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #53	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4212.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #54	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4209.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #55	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4238.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #56	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4211.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #57	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4204.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #58	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4198.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #59	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4216.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #6	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4214.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #60	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4211.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #61	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4206.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #62	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4201.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #63	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4193.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #64	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4231.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #65	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4220.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #66	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4202.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #67	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4208.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #68	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4201.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #69	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4184.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #7	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4197.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #70	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4207.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #71	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4226.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #72	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4218.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #73	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4229.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #74	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4211.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #75	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4240.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #76	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4200.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #77	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4211.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #78	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4199.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #79	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4224.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #8	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4200.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #80	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4213.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #81	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4189.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #82	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4217.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #83	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4196.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #84	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4224.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #85	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4216.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #86	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4218.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #87	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4202.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #88	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4204.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #89	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4197.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #9	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4249.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #90	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4180.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #91	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4221.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #92	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4214.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #93	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4224.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #94	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4207.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #95	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4200.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #96	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4208.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #97	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4196.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #98	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4215.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,3TMS,isomer #99	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4186.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #1	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4131.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #10	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4095.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #100	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4090.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #101	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4094.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #102	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4090.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #103	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4075.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #104	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4073.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #105	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4098.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #106	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4119.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #107	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4127.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #108	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4120.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #109	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4118.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #11	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4108.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #110	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4119.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #111	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4116.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #112	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4111.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #113	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4106.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #114	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4103.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #115	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4104.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #116	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4113.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #117	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4112.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #118	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4101.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #119	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4098.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #12	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4100.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #120	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4133.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #121	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4129.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #122	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4104.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #123	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4100.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #124	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4099.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #125	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4106.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #126	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4107.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #127	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4106.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #128	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4092.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #129	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4091.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #13	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4096.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #130	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4117.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #131	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4101.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #132	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4110.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #133	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4105.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #134	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4087.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #135	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4084.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #136	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4117.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #137	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4091.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #138	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4087.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #139	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4117.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #14	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4118.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #140	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4105.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #141	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4112.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #142	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4101.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #143	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4099.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #144	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4091.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #145	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4119.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #146	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4111.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #147	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4099.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #148	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4079.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #149	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4110.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #15	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4101.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #150	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4106.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #151	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4085.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #152	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4115.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #153	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4077.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #154	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4107.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #155	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4088.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #156	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4104.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #157	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4118.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #158	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4108.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #159	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4134.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #16	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4104.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #160	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4106.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #161	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4097.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #162	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4124.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #163	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4096.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #164	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4130.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #165	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4117.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #166	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4115.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #167	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4081.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #168	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4114.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #169	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4090.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #17	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4103.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #170	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4120.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #171	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4106.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #172	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C41C	4087.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #173	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4123.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #174	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4101.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #175	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4105.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #176	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4104.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #177	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4095.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #178	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4092.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #179	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4083.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #18	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4094.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #180	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4108.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #181	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4096.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #182	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4077.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #183	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4098.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #184	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4084.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #185	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4071.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #186	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4099.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #187	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4105.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #188	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4098.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #189	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4098.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #19	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4088.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #190	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4092.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #191	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4084.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #192	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4107.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #193	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4084.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #194	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4085.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #195	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C41C	4081.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #196	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4132.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #197	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4129.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #198	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4116.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #199	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4134.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #2	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4119.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #20	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4099.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #200	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4117.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #201	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4121.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #202	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4132.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #203	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4129.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #204	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4127.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #205	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4126.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #206	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4146.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #207	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4137.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #208	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4152.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #209	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4149.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #21	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4094.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #210	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4149.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #22	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4085.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #23	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4086.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #24	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4077.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #25	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4073.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #26	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4107.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #27	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4105.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #28	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4114.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #29	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4126.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #3	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4116.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #30	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4133.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #31	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4123.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #32	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4135.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #33	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4120.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #34	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4125.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #35	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4122.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #36	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4116.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #37	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4114.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #38	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4108.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #39	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4104.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #4	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4107.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #40	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4107.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #41	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4122.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #42	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4118.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #43	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4109.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #44	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4110.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #45	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4104.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #46	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4099.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #47	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4134.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #48	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4131.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #49	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4144.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #5	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4117.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #50	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4129.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #51	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4104.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #52	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4113.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #53	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4102.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #54	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4102.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #55	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4106.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #56	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4121.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #57	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4109.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #58	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4108.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #59	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4106.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #6	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4112.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #60	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4096.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #61	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4093.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #62	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4124.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #63	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4123.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #64	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4131.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #65	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4101.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #66	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4115.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #67	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4112.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #68	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4103.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #69	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4097.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #7	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4106.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #70	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4085.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #71	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4085.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #72	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4122.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #73	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4117.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #74	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4129.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #75	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)C41C	4099.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #76	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)C41C	4092.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #77	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)C41C	4085.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #78	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4124.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #79	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4118.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #8	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4128.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #80	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4130.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #81	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4109.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #82	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4109.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #83	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4115.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #84	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C41C	4155.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #85	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4123.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #86	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4112.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #87	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4112.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #88	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4101.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #89	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4102.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #9	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)C41C	4116.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #90	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O[Si](C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4101.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #91	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4128.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #92	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4117.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #93	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4096.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #94	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4096.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #95	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4095.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #96	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O[Si](C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4117.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #97	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O[Si](C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C41C	4101.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #98	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C41C	4101.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,4TMS,isomer #99	CC1CCC2(O[Si](C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C41C	4097.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #1	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4660.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #10	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4683.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #2	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4686.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #3	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4670.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #4	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4656.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #5	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4681.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #6	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4687.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #7	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4714.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #8	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4688.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,1TBDMS,isomer #9	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4681.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #1	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4758.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #10	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4796.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #11	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4821.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #12	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4817.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #13	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4797.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #14	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4802.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #15	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4803.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #16	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4816.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #17	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4806.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #18	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4778.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #19	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4814.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #2	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4784.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #20	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4802.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #21	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4783.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #22	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4792.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #23	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4787.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #24	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C41C	4829.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #25	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4765.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #26	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4785.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #27	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4780.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #28	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4762.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #29	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4770.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #3	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4778.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #30	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4765.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #31	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4784.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #32	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4809.6	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #33	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4802.7	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #34	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4785.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #35	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4795.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #36	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4795.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #37	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4829.1	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #38	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4816.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #39	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4813.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #4	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4758.0	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #40	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4831.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #41	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4835.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #42	CC1CCC2(O)C3(C)CC4(O[Si](C)(C)C(C)(C)C)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4815.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #43	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4809.4	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #44	CC1CCC2(O)C3(C)CC4(O)OC2(C1O[Si](C)(C)C(C)(C)C)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4807.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #45	CC1CCC2(O[Si](C)(C)C(C)(C)C)C3(C)CC4(O)OC2(C1O)C1(O[Si](C)(C)C(C)(C)C)C3(O)CC(O)(C(C)COC2OC(CO)C(O)C(O)C2O)C41C	4802.3	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #5	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O[Si](C)(C)C(C)(C)C)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4764.5	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #6	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O[Si](C)(C)C(C)(C)C)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)C41C	4761.8	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #7	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C41C	4782.2	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #8	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C41C	4791.9	Semi standard non polar	33892256
19-Hydroxycinnzeylanol 19-glucoside,2TBDMS,isomer #9	CC1CCC2(O)C3(C)CC4(O)OC2(C1O)C1(O)C3(O)CC(O)(C(C)COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C41C	4769.3	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (Non-derivatized) - 70eV, Positive	splash10-0597-9310060000-2612b395e2ef695da4e2	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (1 TMS) - 70eV, Positive	splash10-014i-9230007000-4e2dc620ae08e97d6b22	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS ("19-Hydroxycinnzeylanol 19-glucoside,1TMS,#1" TMS) - 70eV, Positive	Not Available	2021-10-14	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_1_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_1) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_2) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_3) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_4) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_5) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_6) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_7) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_8) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_9) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_10) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_11) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside GC-MS (TMS_2_12) - 70eV, Positive	Not Available	2021-10-15	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 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 - 19-Hydroxycinnzeylanol 19-glucoside 10V, Positive-QTOF	splash10-01pk-0004090000-c1ac94c9632b390f3df0	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 20V, Positive-QTOF	splash10-001i-1109120000-56139f6868bfd6df56c6	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 40V, Positive-QTOF	splash10-00lr-5209010000-a4f32cb1b69c43b3ef9c	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 10V, Negative-QTOF	splash10-03di-0202190000-ef10120213e791e43486	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 20V, Negative-QTOF	splash10-03dl-5709160000-fb68cad94d31a6855489	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 40V, Negative-QTOF	splash10-0007-9206000000-ba2aecfcda7148678fea	2017-09-01	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 10V, Negative-QTOF	splash10-03di-0000090000-93c42d19eb493f59d562	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 20V, Negative-QTOF	splash10-03di-2000390000-6fa511f7d63791e802b4	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 40V, Negative-QTOF	splash10-0a4i-9000100000-b58a2d26cefbfcc89a01	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 10V, Positive-QTOF	splash10-03di-0000090000-32b6b56fba36be9a6943	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 20V, Positive-QTOF	splash10-0159-2009130000-dcdb9d9e6e2b4d29f059	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 19-Hydroxycinnzeylanol 19-glucoside 40V, Positive-QTOF	splash10-0a4j-9102000000-f13ac51373c6a357bcba	2021-09-22	Wishart Lab	View Spectrum

NMR Spectra

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

Biological Properties

Cellular Locations

Cytoplasm
Extracellular
Membrane

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

FDB015810

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

131752068

PDB ID

Not Available

ChEBI ID

191706

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

Simons K, Toomre D: Lipid rafts and signal transduction. Nat Rev Mol Cell Biol. 2000 Oct;1(1):31-9. [PubMed:11413487 ]
Watson AD: Thematic review series: systems biology approaches to metabolic and cardiovascular disorders. Lipidomics: a global approach to lipid analysis in biological systems. J Lipid Res. 2006 Oct;47(10):2101-11. Epub 2006 Aug 10. [PubMed:16902246 ]
Sethi JK, Vidal-Puig AJ: Thematic review series: adipocyte biology. Adipose tissue function and plasticity orchestrate nutritional adaptation. J Lipid Res. 2007 Jun;48(6):1253-62. Epub 2007 Mar 20. [PubMed:17374880 ]
Lingwood D, Simons K: Lipid rafts as a membrane-organizing principle. Science. 2010 Jan 1;327(5961):46-50. doi: 10.1126/science.1174621. [PubMed:20044567 ]
(). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
Gunstone, Frank D., John L. Harwood, and Albert J. Dijkstra (2007). The lipid handbook with CD-ROM. CRC Press.

Showing metabocard for 19-Hydroxycinnzeylanol 19-glucoside (HMDB0036856)

MOL for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

3D MOL for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

3D SDF for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

3D-SDF for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

PDB for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

3D PDB for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

SMILES for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

INCHI for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

Structure for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

3D Structure for HMDB0036856 (19-Hydroxycinnzeylanol 19-glucoside)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra