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Record Information

Version

5.0

Status

Expected but not Quantified

Creation Date

2012-09-12 00:41:06 UTC

Update Date

2022-03-07 02:56:09 UTC

HMDB ID

HMDB0039284

Secondary Accession Numbers

HMDB39284

Metabolite Identification

Common Name

4'-O-Galloylsucrose

Description

4'-O-Galloylsucrose belongs to the class of organic compounds known as galloyl esters. These are organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid. 4'-O-Galloylsucrose has been detected, but not quantified in, green vegetables. This could make 4'-O-galloylsucrose a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on 4'-O-Galloylsucrose.

Structure

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

  Mrv0541 05061310582D          

 34 36  0  0  0  0            999 V2000
   -2.0841    0.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2402    1.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3549    6.3696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6806    1.9072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3352    4.4573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4197    1.3260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5691   -0.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7251    0.7448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5480    6.1981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1956    2.5747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3895   -0.0088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0041    6.8112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8111    6.6397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0660    5.8550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6294    2.5747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843    3.3593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9348    1.9935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5140    5.2419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2169    3.8442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6099    7.1542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5010    1.9935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1421    4.2858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2335   -0.8487    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5456    0.8311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8745   -0.6763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2509    7.5958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3631    7.2528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8730    5.6835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6689    3.6142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2703    2.7472    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2930    5.4135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1143    1.9072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4506    3.3593    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7689    4.4573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  2  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 11  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  9  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 10  1  0  0  0  0
 16 15  1  0  0  0  0
 17  6  1  0  0  0  0
 18 14  1  0  0  0  0
 19  5  1  0  0  0  0
 19 16  1  0  0  0  0
 20  3  1  0  0  0  0
 21  4  1  0  0  0  0
 22  5  1  0  0  0  0
 23  7  1  0  0  0  0
 24  8  1  0  0  0  0
 25 11  1  0  0  0  0
 26 12  1  0  0  0  0
 27 13  1  0  0  0  0
 28 14  1  0  0  0  0
 29 16  1  0  0  0  0
 30 17  2  0  0  0  0
 31  9  1  0  0  0  0
 31 18  1  0  0  0  0
 32 15  1  0  0  0  0
 32 17  1  0  0  0  0
 33 10  1  0  0  0  0
 33 19  1  0  0  0  0
 34 18  1  0  0  0  0
 34 19  1  0  0  0  0
M  END

HMDB0039284
     RDKit          3D
4'-O-Galloylsucrose
 60 62  0  0  0  0  0  0  0  0999 V2000
    3.6541   -0.0743   -1.9353 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4553   -0.1819   -0.7116 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1510   -0.4363   -0.3057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0764   -0.5714   -1.2301 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3951   -1.9003   -0.9872 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0693   -3.0302   -1.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4144   -3.0988   -1.3556 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9221   -1.7474   -1.2690 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2374   -0.3999   -1.3435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.0749   -2.8024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4122   -0.3292   -3.6276 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3967   -0.2354   -0.6101 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9029    1.0181   -0.5365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8014    1.4675    0.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8219    1.1177    1.5931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3492    0.5244    2.9211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5351    0.2248    3.6311 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8444    0.1969    1.0247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4123   -1.0995    0.8484 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3924    0.8335   -0.2199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0771    1.9983    0.1993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2711    1.1965   -1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4474    2.5198   -1.5466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0656    0.3433   -0.8563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0078    0.3994    0.5612 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5529   -0.0435    0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3619   -0.1578    1.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4290   -0.0213    2.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2187   -0.1387    3.8180 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6920    0.2303    1.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7750    0.3705    2.8468 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8934    0.3464    0.6242 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1663    0.5982    0.1714 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8177    0.2081   -0.2487 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4386   -0.4460   -2.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5013   -2.1079    0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6077   -3.9771   -1.4362 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0223   -2.9317   -2.8059 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5471   -3.3661   -0.4126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3288   -0.7394   -3.1882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7654    0.9929   -2.9635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4418   -1.2896   -3.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2345    1.7097   -1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3639    2.0648    1.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8221    1.2762    3.5381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8131   -0.4186    2.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1224    1.0429    3.6810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7001    0.1636    1.7611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7919   -1.4700   -0.0017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1709    0.2048   -0.7058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0151    2.7187   -0.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3438    0.5727   -2.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5663    2.9831   -1.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560    1.3607   -1.2821 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7748    0.9804    0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3768   -0.3567    2.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3054   -0.3234    4.2115 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6770    0.2943    3.8394 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4099    0.6993   -0.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0374    0.3097   -1.3077 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  5  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  9 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 15 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
  9 24  1  0
 24 25  1  0
  2 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32 34  2  0
 24  4  1  0
 34 26  1  0
 22 13  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
 10 40  1  0
 10 41  1  0
 11 42  1  0
 13 43  1  0
 15 44  1  0
 16 45  1  0
 16 46  1  0
 17 47  1  0
 18 48  1  0
 19 49  1  0
 20 50  1  0
 21 51  1  0
 22 52  1  0
 23 53  1  0
 24 54  1  0
 25 55  1  0
 27 56  1  0
 29 57  1  0
 31 58  1  0
 33 59  1  0
 34 60  1  0
M  END

  Mrv0541 05061310582D          

 34 36  0  0  0  0            999 V2000
   -2.0841    0.5724    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2402    1.4123    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3549    6.3696    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6806    1.9072    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3352    4.4573    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4197    1.3260    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5691   -0.0951    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7251    0.7448    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5480    6.1981    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1956    2.5747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3895   -0.0088    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0041    6.8112    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8111    6.6397    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0660    5.8550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6294    2.5747    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8843    3.3593    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9348    1.9935    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5140    5.2419    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2169    3.8442    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6099    7.1542    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5010    1.9935    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.1421    4.2858    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2335   -0.8487    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5456    0.8311    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8745   -0.6763    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2509    7.5958    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3631    7.2528    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8730    5.6835    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6689    3.6142    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2703    2.7472    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2930    5.4135    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1143    1.9072    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4506    3.3593    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7689    4.4573    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  6  1  2  0  0  0  0
  6  2  1  0  0  0  0
  7  1  1  0  0  0  0
  8  2  2  0  0  0  0
  9  3  1  0  0  0  0
 10  4  1  0  0  0  0
 11  7  2  0  0  0  0
 11  8  1  0  0  0  0
 12  9  1  0  0  0  0
 13 12  1  0  0  0  0
 14 13  1  0  0  0  0
 15 10  1  0  0  0  0
 16 15  1  0  0  0  0
 17  6  1  0  0  0  0
 18 14  1  0  0  0  0
 19  5  1  0  0  0  0
 19 16  1  0  0  0  0
 20  3  1  0  0  0  0
 21  4  1  0  0  0  0
 22  5  1  0  0  0  0
 23  7  1  0  0  0  0
 24  8  1  0  0  0  0
 25 11  1  0  0  0  0
 26 12  1  0  0  0  0
 27 13  1  0  0  0  0
 28 14  1  0  0  0  0
 29 16  1  0  0  0  0
 30 17  2  0  0  0  0
 31  9  1  0  0  0  0
 31 18  1  0  0  0  0
 32 15  1  0  0  0  0
 32 17  1  0  0  0  0
 33 10  1  0  0  0  0
 33 19  1  0  0  0  0
 34 18  1  0  0  0  0
 34 19  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0039284

> <DATABASE_NAME>
hmdb

> <SMILES>
OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1

> <INCHI_IDENTIFIER>
InChI=1S/C19H26O15/c20-3-9-12(26)13(27)14(28)18(31-9)34-19(5-22)16(29)15(10(4-21)33-19)32-17(30)6-1-7(23)11(25)8(24)2-6/h1-2,9-10,12-16,18,20-29H,3-5H2

> <INCHI_KEY>
VQNOKSMTUKSLMO-UHFFFAOYSA-N

> <FORMULA>
C19H26O15

> <MOLECULAR_WEIGHT>
494.4007

> <EXACT_MASS>
494.127170162

> <JCHEM_ACCEPTOR_COUNT>
14

> <JCHEM_AVERAGE_POLARIZABILITY>
44.78114976092608

> <JCHEM_BIOAVAILABILITY>
0

> <JCHEM_DONOR_COUNT>
10

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
4-hydroxy-2,5-bis(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3,4,5-trihydroxybenzoate

> <ALOGPS_LOGP>
-1.47

> <JCHEM_LOGP>
-2.94423108

> <ALOGPS_LOGS>
-1.11

> <JCHEM_MDDR_LIKE_RULE>
1

> <JCHEM_NUMBER_OF_RINGS>
3

> <JCHEM_PHYSIOLOGICAL_CHARGE>
0

> <JCHEM_PKA>
11.183626187623345

> <JCHEM_PKA_STRONGEST_ACIDIC>
8.103036868379565

> <JCHEM_PKA_STRONGEST_BASIC>
-3.4558459877293464

> <JCHEM_POLAR_SURFACE_AREA>
256.28999999999996

> <JCHEM_REFRACTIVITY>
104.5388

> <JCHEM_ROTATABLE_BOND_COUNT>
8

> <JCHEM_RULE_OF_FIVE>
0

> <ALOGPS_SOLUBILITY>
3.80e+01 g/l

> <JCHEM_TRADITIONAL_IUPAC>
4-hydroxy-2,5-bis(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3,4,5-trihydroxybenzoate

> <JCHEM_VEBER_RULE>
0

$$$$

HMDB0039284
     RDKit          3D
4'-O-Galloylsucrose
 60 62  0  0  0  0  0  0  0  0999 V2000
    3.6541   -0.0743   -1.9353 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4553   -0.1819   -0.7116 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1510   -0.4363   -0.3057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0764   -0.5714   -1.2301 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3951   -1.9003   -0.9872 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0693   -3.0302   -1.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4144   -3.0988   -1.3556 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9221   -1.7474   -1.2690 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2374   -0.3999   -1.3435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.0749   -2.8024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4122   -0.3292   -3.6276 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3967   -0.2354   -0.6101 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9029    1.0181   -0.5365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8014    1.4675    0.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8219    1.1177    1.5931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3492    0.5244    2.9211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5351    0.2248    3.6311 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8444    0.1969    1.0247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4123   -1.0995    0.8484 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3924    0.8335   -0.2199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0771    1.9983    0.1993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2711    1.1965   -1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4474    2.5198   -1.5466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0656    0.3433   -0.8563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0078    0.3994    0.5612 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5529   -0.0435    0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3619   -0.1578    1.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4290   -0.0213    2.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2187   -0.1387    3.8180 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6920    0.2303    1.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7750    0.3705    2.8468 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8934    0.3464    0.6242 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1663    0.5982    0.1714 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8177    0.2081   -0.2487 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4386   -0.4460   -2.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5013   -2.1079    0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6077   -3.9771   -1.4362 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0223   -2.9317   -2.8059 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5471   -3.3661   -0.4126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3288   -0.7394   -3.1882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7654    0.9929   -2.9635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4418   -1.2896   -3.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2345    1.7097   -1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3639    2.0648    1.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8221    1.2762    3.5381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8131   -0.4186    2.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1224    1.0429    3.6810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7001    0.1636    1.7611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7919   -1.4700   -0.0017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1709    0.2048   -0.7058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0151    2.7187   -0.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3438    0.5727   -2.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5663    2.9831   -1.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560    1.3607   -1.2821 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7748    0.9804    0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3768   -0.3567    2.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3054   -0.3234    4.2115 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6770    0.2943    3.8394 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4099    0.6993   -0.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0374    0.3097   -1.3077 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  5  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  9 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 15 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
  9 24  1  0
 24 25  1  0
  2 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32 34  2  0
 24  4  1  0
 34 26  1  0
 22 13  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
 10 40  1  0
 10 41  1  0
 11 42  1  0
 13 43  1  0
 15 44  1  0
 16 45  1  0
 16 46  1  0
 17 47  1  0
 18 48  1  0
 19 49  1  0
 20 50  1  0
 21 51  1  0
 22 52  1  0
 23 53  1  0
 24 54  1  0
 25 55  1  0
 27 56  1  0
 29 57  1  0
 31 58  1  0
 33 59  1  0
 34 60  1  0
M  END

HEADER    PROTEIN                                 06-MAY-13   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   06-MAY-13         0                                  
HETATM    1  C   UNK     0      -3.890   1.068   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      -6.048   2.636   0.000  0.00  0.00           C+0
HETATM    3  C   UNK     0       2.529  11.890   0.000  0.00  0.00           C+0
HETATM    4  C   UNK     0       1.270   3.560   0.000  0.00  0.00           C+0
HETATM    5  C   UNK     0       0.626   8.320   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      -4.517   2.475   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0      -4.796  -0.178   0.000  0.00  0.00           C+0
HETATM    8  C   UNK     0      -6.954   1.390   0.000  0.00  0.00           C+0
HETATM    9  C   UNK     0       1.023  11.570   0.000  0.00  0.00           C+0
HETATM   10  C   UNK     0       0.365   4.806   0.000  0.00  0.00           C+0
HETATM   11  C   UNK     0      -6.327  -0.016   0.000  0.00  0.00           C+0
HETATM   12  C   UNK     0      -0.008  12.714   0.000  0.00  0.00           C+0
HETATM   13  C   UNK     0      -1.514  12.394   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0      -1.990  10.929   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0      -1.175   4.806   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0      -1.651   6.271   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      -3.612   3.721   0.000  0.00  0.00           C+0
HETATM   18  C   UNK     0      -0.959   9.785   0.000  0.00  0.00           C+0
HETATM   19  C   UNK     0      -0.405   7.176   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0       3.005  13.355   0.000  0.00  0.00           O+0
HETATM   21  O   UNK     0       2.802   3.721   0.000  0.00  0.00           O+0
HETATM   22  O   UNK     0       2.132   8.000   0.000  0.00  0.00           O+0
HETATM   23  O   UNK     0      -4.169  -1.584   0.000  0.00  0.00           O+0
HETATM   24  O   UNK     0      -8.485   1.551   0.000  0.00  0.00           O+0
HETATM   25  O   UNK     0      -7.232  -1.262   0.000  0.00  0.00           O+0
HETATM   26  O   UNK     0       0.468  14.179   0.000  0.00  0.00           O+0
HETATM   27  O   UNK     0      -2.544  13.539   0.000  0.00  0.00           O+0
HETATM   28  O   UNK     0      -3.496  10.609   0.000  0.00  0.00           O+0
HETATM   29  O   UNK     0      -3.115   6.747   0.000  0.00  0.00           O+0
HETATM   30  O   UNK     0      -4.238   5.128   0.000  0.00  0.00           O+0
HETATM   31  O   UNK     0       0.547  10.105   0.000  0.00  0.00           O+0
HETATM   32  O   UNK     0      -2.080   3.560   0.000  0.00  0.00           O+0
HETATM   33  O   UNK     0       0.841   6.271   0.000  0.00  0.00           O+0
HETATM   34  O   UNK     0      -1.435   8.320   0.000  0.00  0.00           O+0
CONECT    1    6    7                                                       
CONECT    2    6    8                                                       
CONECT    3    9   20                                                       
CONECT    4   10   21                                                       
CONECT    5   19   22                                                       
CONECT    6    1    2   17                                                  
CONECT    7    1   11   23                                                  
CONECT    8    2   11   24                                                  
CONECT    9    3   12   31                                                  
CONECT   10    4   15   33                                                  
CONECT   11    7    8   25                                                  
CONECT   12    9   13   26                                                  
CONECT   13   12   14   27                                                  
CONECT   14   13   18   28                                                  
CONECT   15   10   16   32                                                  
CONECT   16   15   19   29                                                  
CONECT   17    6   30   32                                                  
CONECT   18   14   31   34                                                  
CONECT   19    5   16   33   34                                             
CONECT   20    3                                                            
CONECT   21    4                                                            
CONECT   22    5                                                            
CONECT   23    7                                                            
CONECT   24    8                                                            
CONECT   25   11                                                            
CONECT   26   12                                                            
CONECT   27   13                                                            
CONECT   28   14                                                            
CONECT   29   16                                                            
CONECT   30   17                                                            
CONECT   31    9   18                                                       
CONECT   32   15   17                                                       
CONECT   33   10   19                                                       
CONECT   34   18   19                                                       
MASTER        0    0    0    0    0    0    0    0   34    0   72    0
END

COMPND    HMDB0039284
HETATM    1  O1  UNL     1       3.654  -0.074  -1.935  1.00  0.00           O  
HETATM    2  C1  UNL     1       3.455  -0.182  -0.712  1.00  0.00           C  
HETATM    3  O2  UNL     1       2.151  -0.436  -0.306  1.00  0.00           O  
HETATM    4  C2  UNL     1       1.076  -0.571  -1.230  1.00  0.00           C  
HETATM    5  C3  UNL     1       0.395  -1.900  -0.987  1.00  0.00           C  
HETATM    6  C4  UNL     1       1.069  -3.030  -1.716  1.00  0.00           C  
HETATM    7  O3  UNL     1       2.414  -3.099  -1.356  1.00  0.00           O  
HETATM    8  O4  UNL     1      -0.922  -1.747  -1.269  1.00  0.00           O  
HETATM    9  C5  UNL     1      -1.237  -0.400  -1.343  1.00  0.00           C  
HETATM   10  C6  UNL     1      -1.500  -0.075  -2.802  1.00  0.00           C  
HETATM   11  O5  UNL     1      -0.412  -0.329  -3.628  1.00  0.00           O  
HETATM   12  O6  UNL     1      -2.397  -0.235  -0.610  1.00  0.00           O  
HETATM   13  C7  UNL     1      -2.903   1.018  -0.537  1.00  0.00           C  
HETATM   14  O7  UNL     1      -2.801   1.467   0.774  1.00  0.00           O  
HETATM   15  C8  UNL     1      -3.822   1.118   1.593  1.00  0.00           C  
HETATM   16  C9  UNL     1      -3.349   0.524   2.921  1.00  0.00           C  
HETATM   17  O8  UNL     1      -4.535   0.225   3.631  1.00  0.00           O  
HETATM   18  C10 UNL     1      -4.844   0.197   1.025  1.00  0.00           C  
HETATM   19  O9  UNL     1      -4.412  -1.099   0.848  1.00  0.00           O  
HETATM   20  C11 UNL     1      -5.392   0.834  -0.220  1.00  0.00           C  
HETATM   21  O10 UNL     1      -6.077   1.998   0.199  1.00  0.00           O  
HETATM   22  C12 UNL     1      -4.271   1.196  -1.124  1.00  0.00           C  
HETATM   23  O11 UNL     1      -4.447   2.520  -1.547  1.00  0.00           O  
HETATM   24  C13 UNL     1      -0.066   0.343  -0.856  1.00  0.00           C  
HETATM   25  O12 UNL     1      -0.008   0.399   0.561  1.00  0.00           O  
HETATM   26  C14 UNL     1       4.553  -0.044   0.227  1.00  0.00           C  
HETATM   27  C15 UNL     1       4.362  -0.158   1.584  1.00  0.00           C  
HETATM   28  C16 UNL     1       5.429  -0.021   2.463  1.00  0.00           C  
HETATM   29  O13 UNL     1       5.219  -0.139   3.818  1.00  0.00           O  
HETATM   30  C17 UNL     1       6.692   0.230   1.983  1.00  0.00           C  
HETATM   31  O14 UNL     1       7.775   0.370   2.847  1.00  0.00           O  
HETATM   32  C18 UNL     1       6.893   0.346   0.624  1.00  0.00           C  
HETATM   33  O15 UNL     1       8.166   0.598   0.171  1.00  0.00           O  
HETATM   34  C19 UNL     1       5.818   0.208  -0.249  1.00  0.00           C  
HETATM   35  H1  UNL     1       1.439  -0.446  -2.267  1.00  0.00           H  
HETATM   36  H2  UNL     1       0.501  -2.108   0.106  1.00  0.00           H  
HETATM   37  H3  UNL     1       0.608  -3.977  -1.436  1.00  0.00           H  
HETATM   38  H4  UNL     1       1.022  -2.932  -2.806  1.00  0.00           H  
HETATM   39  H5  UNL     1       2.547  -3.366  -0.413  1.00  0.00           H  
HETATM   40  H6  UNL     1      -2.329  -0.739  -3.188  1.00  0.00           H  
HETATM   41  H7  UNL     1      -1.765   0.993  -2.963  1.00  0.00           H  
HETATM   42  H8  UNL     1      -0.442  -1.290  -3.935  1.00  0.00           H  
HETATM   43  H9  UNL     1      -2.234   1.710  -1.120  1.00  0.00           H  
HETATM   44  H10 UNL     1      -4.364   2.065   1.888  1.00  0.00           H  
HETATM   45  H11 UNL     1      -2.822   1.276   3.538  1.00  0.00           H  
HETATM   46  H12 UNL     1      -2.813  -0.419   2.793  1.00  0.00           H  
HETATM   47  H13 UNL     1      -5.122   1.043   3.681  1.00  0.00           H  
HETATM   48  H14 UNL     1      -5.700   0.164   1.761  1.00  0.00           H  
HETATM   49  H15 UNL     1      -4.792  -1.470  -0.002  1.00  0.00           H  
HETATM   50  H16 UNL     1      -6.171   0.205  -0.706  1.00  0.00           H  
HETATM   51  H17 UNL     1      -6.015   2.719  -0.447  1.00  0.00           H  
HETATM   52  H18 UNL     1      -4.344   0.573  -2.038  1.00  0.00           H  
HETATM   53  H19 UNL     1      -3.566   2.983  -1.524  1.00  0.00           H  
HETATM   54  H20 UNL     1       0.056   1.361  -1.282  1.00  0.00           H  
HETATM   55  H21 UNL     1       0.775   0.980   0.756  1.00  0.00           H  
HETATM   56  H22 UNL     1       3.377  -0.357   2.004  1.00  0.00           H  
HETATM   57  H23 UNL     1       4.305  -0.323   4.211  1.00  0.00           H  
HETATM   58  H24 UNL     1       7.677   0.294   3.839  1.00  0.00           H  
HETATM   59  H25 UNL     1       8.410   0.699  -0.809  1.00  0.00           H  
HETATM   60  H26 UNL     1       6.037   0.310  -1.308  1.00  0.00           H  
CONECT    1    2    2
CONECT    2    3   26
CONECT    3    4
CONECT    4    5   24   35
CONECT    5    6    8   36
CONECT    6    7   37   38
CONECT    7   39
CONECT    8    9
CONECT    9   10   12   24
CONECT   10   11   40   41
CONECT   11   42
CONECT   12   13
CONECT   13   14   22   43
CONECT   14   15
CONECT   15   16   18   44
CONECT   16   17   45   46
CONECT   17   47
CONECT   18   19   20   48
CONECT   19   49
CONECT   20   21   22   50
CONECT   21   51
CONECT   22   23   52
CONECT   23   53
CONECT   24   25   54
CONECT   25   55
CONECT   26   27   27   34
CONECT   27   28   56
CONECT   28   29   30   30
CONECT   29   57
CONECT   30   31   32
CONECT   31   58
CONECT   32   33   34   34
CONECT   33   59
CONECT   34   60
END

HMDB0039284
     RDKit          3D
4'-O-Galloylsucrose
 60 62  0  0  0  0  0  0  0  0999 V2000
    3.6541   -0.0743   -1.9353 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.4553   -0.1819   -0.7116 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1510   -0.4363   -0.3057 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0764   -0.5714   -1.2301 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3951   -1.9003   -0.9872 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0693   -3.0302   -1.7157 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4144   -3.0988   -1.3556 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9221   -1.7474   -1.2690 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2374   -0.3999   -1.3435 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5000   -0.0749   -2.8024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4122   -0.3292   -3.6276 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3967   -0.2354   -0.6101 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9029    1.0181   -0.5365 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8014    1.4675    0.7742 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8219    1.1177    1.5931 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3492    0.5244    2.9211 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5351    0.2248    3.6311 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8444    0.1969    1.0247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4123   -1.0995    0.8484 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3924    0.8335   -0.2199 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0771    1.9983    0.1993 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2711    1.1965   -1.1241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4474    2.5198   -1.5466 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0656    0.3433   -0.8563 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0078    0.3994    0.5612 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5529   -0.0435    0.2267 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3619   -0.1578    1.5842 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4290   -0.0213    2.4633 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2187   -0.1387    3.8180 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6920    0.2303    1.9830 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7750    0.3705    2.8468 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.8934    0.3464    0.6242 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1663    0.5982    0.1714 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.8177    0.2081   -0.2487 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4386   -0.4460   -2.2671 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5013   -2.1079    0.1057 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6077   -3.9771   -1.4362 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0223   -2.9317   -2.8059 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5471   -3.3661   -0.4126 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3288   -0.7394   -3.1882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7654    0.9929   -2.9635 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4418   -1.2896   -3.9354 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2345    1.7097   -1.1201 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3639    2.0648    1.8882 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8221    1.2762    3.5381 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8131   -0.4186    2.7932 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1224    1.0429    3.6810 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7001    0.1636    1.7611 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7919   -1.4700   -0.0017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1709    0.2048   -0.7058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0151    2.7187   -0.4470 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3438    0.5727   -2.0380 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5663    2.9831   -1.5241 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0560    1.3607   -1.2821 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7748    0.9804    0.7564 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3768   -0.3567    2.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3054   -0.3234    4.2115 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6770    0.2943    3.8394 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.4099    0.6993   -0.8086 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0374    0.3097   -1.3077 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  2  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  5  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
  9 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  1  0
 15 16  1  0
 16 17  1  0
 15 18  1  0
 18 19  1  0
 18 20  1  0
 20 21  1  0
 20 22  1  0
 22 23  1  0
  9 24  1  0
 24 25  1  0
  2 26  1  0
 26 27  2  0
 27 28  1  0
 28 29  1  0
 28 30  2  0
 30 31  1  0
 30 32  1  0
 32 33  1  0
 32 34  2  0
 24  4  1  0
 34 26  1  0
 22 13  1  0
  4 35  1  0
  5 36  1  0
  6 37  1  0
  6 38  1  0
  7 39  1  0
 10 40  1  0
 10 41  1  0
 11 42  1  0
 13 43  1  0
 15 44  1  0
 16 45  1  0
 16 46  1  0
 17 47  1  0
 18 48  1  0
 19 49  1  0
 20 50  1  0
 21 51  1  0
 22 52  1  0
 23 53  1  0
 24 54  1  0
 25 55  1  0
 27 56  1  0
 29 57  1  0
 31 58  1  0
 33 59  1  0
 34 60  1  0
M  END

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
4-Hydroxy-2,5-bis(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3,4,5-trihydroxybenzoic acid	HMDB

Chemical Formula

C₁₉H₂₆O₁₅

Average Molecular Weight

494.4007

Monoisotopic Molecular Weight

494.127170162

IUPAC Name

4-hydroxy-2,5-bis(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3,4,5-trihydroxybenzoate

Traditional Name

4-hydroxy-2,5-bis(hydroxymethyl)-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxolan-3-yl 3,4,5-trihydroxybenzoate

CAS Registry Number

115713-44-5

SMILES

OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1

InChI Identifier

InChI=1S/C19H26O15/c20-3-9-12(26)13(27)14(28)18(31-9)34-19(5-22)16(29)15(10(4-21)33-19)32-17(30)6-1-7(23)11(25)8(24)2-6/h1-2,9-10,12-16,18,20-29H,3-5H2

InChI Key

VQNOKSMTUKSLMO-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as galloyl esters. These are organic compounds that contain an ester derivative of 3,4,5-trihydroxybenzoic acid.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Benzoic acids and derivatives

Direct Parent

Galloyl esters

Alternative Parents

Substituents

Galloyl ester
P-hydroxybenzoic acid alkyl ester
M-hydroxybenzoic acid ester
P-hydroxybenzoic acid ester
O-glycosyl compound
Glycosyl compound
Disaccharide
C-glycosyl compound
Benzoate ester
Benzenetriol
Pyrogallol derivative
Benzoyl
Ketal
1-hydroxy-4-unsubstituted benzenoid
1-hydroxy-2-unsubstituted benzenoid
Phenol
Oxane
Tetrahydrofuran
Secondary alcohol
Carboxylic acid ester
Acetal
Oxacycle
Carboxylic acid derivative
Organoheterocyclic compound
Polyol
Monocarboxylic acid or derivatives
Alcohol
Organic oxygen compound
Primary alcohol
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Aromatic heteromonocyclic compound

Molecular Framework

Aromatic heteromonocyclic compounds

External Descriptors

Not Available

Ontology

Physiological effect

Not Available

Disposition

Biological location

Cellular substructure

Extracellular (HMDB: HMDB0039284)
Cytoplasm (HMDB: HMDB0039284)

Route of exposure

Enteral

Ingestion (HMDB: HMDB0039284)

Source

Exogenous

Exogenous (HMDB: HMDB0039284)

Food

Food (HMDB: HMDB0039284)

Vegetable

Leaf vegetable

Green vegetables (FooDB: FOOD00872)

Endogenous

Plant

Plant (HMDB: HMDB0039284)

Process

Not Available

Role

Biological role

Nutrient (HMDB: HMDB0039284)

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	38 g/L	ALOGPS
logP	-1.5	ALOGPS
logP	-2.9	ChemAxon
logS	-1.1	ALOGPS
pKa (Strongest Acidic)	8.1	ChemAxon
pKa (Strongest Basic)	-3.5	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	14	ChemAxon
Hydrogen Donor Count	10	ChemAxon
Polar Surface Area	256.29 Å²	ChemAxon
Rotatable Bond Count	8	ChemAxon
Refractivity	104.54 m³·mol⁻¹	ChemAxon
Polarizability	44.78 Å³	ChemAxon
Number of Rings	3	ChemAxon
Bioavailability	No	ChemAxon
Rule of Five	No	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	Yes	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	209.507	31661259
DarkChem	[M-H]-	202.445	31661259
DeepCCS	[M+H]+	215.873	30932474
DeepCCS	[M-H]-	213.514	30932474
DeepCCS	[M-2H]-	246.479	30932474
DeepCCS	[M+Na]+	222.984	30932474
AllCCS	[M+H]+	206.6	32859911
AllCCS	[M+H-H2O]+	204.9	32859911
AllCCS	[M+NH4]+	208.3	32859911
AllCCS	[M+Na]+	208.7	32859911
AllCCS	[M-H]-	203.3	32859911
AllCCS	[M+Na-2H]-	204.0	32859911
AllCCS	[M+HCOO]-	204.8	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
4'-O-Galloylsucrose	OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4203.3	Standard polar	33892256
4'-O-Galloylsucrose	OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4335.4	Standard non polar	33892256
4'-O-Galloylsucrose	OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4208.6	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
4'-O-Galloylsucrose,1TMS,isomer #1	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4334.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #2	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4335.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4329.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #4	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C1O	4336.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #5	C[Si](C)(C)OC1C(O)C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C1O	4325.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #6	C[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)OC(CO)C(O)C1O	4351.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #7	C[Si](C)(C)OC1C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(CO)OC1(CO)OC1OC(CO)C(O)C(O)C1O	4381.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #8	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O)=C1O	4313.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TMS,isomer #9	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)C=C1O	4293.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #1	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4252.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #10	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4267.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #11	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4249.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #12	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4281.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #13	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	4213.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #14	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	4178.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #15	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4267.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	4208.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #17	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4172.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #18	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	4276.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #19	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	4278.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4272.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #20	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	4249.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #21	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	4266.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #22	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O)=CC(O)=C1O	4213.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #23	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O)C=C1O	4183.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #24	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C1O	4286.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #25	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C1O	4268.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #26	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C1O[Si](C)(C)C	4282.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #27	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O)=CC(O)=C1O	4188.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #28	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O)C=C1O	4161.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #29	C[Si](C)(C)OC1C(O)C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C1O	4270.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #3	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4281.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #30	C[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)OC(CO)C(O)C1O[Si](C)(C)C	4291.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #31	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O)=CC(O)=C1O	4221.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #32	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O)C=C1O	4183.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #33	C[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)OC(CO)C(O)C1O	4299.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #34	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C)=CC(O)=C1O	4242.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #35	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C)C=C1O	4201.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #36	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O[Si](C)(C)C)=C1O	4217.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #37	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O)=C1O[Si](C)(C)C	4176.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #4	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4268.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #5	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4296.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #6	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4288.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #7	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4233.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #8	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4194.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4259.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4120.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	4140.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	4160.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	4138.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	4142.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #14	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4167.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #15	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4163.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #16	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4162.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #17	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4097.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #18	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4053.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #19	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4155.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #2	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4133.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #20	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4143.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #21	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4067.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #22	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4029.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #23	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4162.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #24	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4103.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #25	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4054.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #26	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4101.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #27	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4056.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #28	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	4078.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #29	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	4049.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #3	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4114.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	4061.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4009.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	4124.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	4137.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	4123.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	4126.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #36	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4148.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #37	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4147.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #38	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	4084.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #39	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	4040.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #4	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4133.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #40	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4143.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #41	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4131.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #42	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	4054.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #43	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	4013.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #44	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4122.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #45	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	4088.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #46	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	4041.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #47	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4142.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #48	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	4068.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #49	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	4038.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #5	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4093.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #50	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	4082.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #51	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	4035.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	4053.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	4021.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	4083.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	4083.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	4055.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	4075.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #58	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	4036.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	4038.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #6	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	4059.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	4019.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	4029.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4150.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #63	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	4134.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #64	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4137.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4128.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4132.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4145.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #68	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O)=CC(O)=C1O	4099.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #69	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O)=CC(O)=C1O	4096.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #7	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	4018.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #70	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O[Si](C)(C)C)=CC(O)=C1O	4112.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #71	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O)=CC(O[Si](C)(C)C)=C1O	4096.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #72	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O)=CC(O)=C1O[Si](C)(C)C	4065.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #73	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O)C=C1O	4072.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #74	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O)C=C1O	4063.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #75	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O[Si](C)(C)C)C=C1O	4072.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #76	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4160.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #77	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4166.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #78	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4166.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #79	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O)=C1O	4092.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	4073.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #80	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O)=C1O	4081.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #81	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O)=CC(O[Si](C)(C)C)=C1O	4055.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #82	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O)=CC(O)=C1O[Si](C)(C)C	4032.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #83	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)C=C1O	4055.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #84	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)C=C1O	4045.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #85	C[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C	4154.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #86	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	4116.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #87	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	4094.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #88	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	4060.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #89	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	4070.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4021.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #90	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	4104.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #91	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	4079.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TMS,isomer #92	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4097.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3896.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #10	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3928.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #100	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3948.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #101	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3891.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #102	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3952.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #103	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3942.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #104	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3921.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #105	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3937.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #106	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3948.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #107	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3938.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #108	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3917.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #109	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3934.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #11	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3875.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #110	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3918.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #111	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3902.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #112	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3893.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #113	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3902.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #114	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3953.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #115	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3939.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #116	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3955.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #117	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3930.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #118	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3945.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #119	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3951.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #12	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3982.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #120	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3900.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #121	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3893.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #122	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3901.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #123	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3884.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #124	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3899.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #125	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3907.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #126	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3996.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #127	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4005.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #128	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4027.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #129	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4017.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #13	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3959.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #130	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O)=C1O	3967.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #131	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O)=C1O	3982.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #132	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O)=CC(O[Si](C)(C)C)=C1O	3967.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #133	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O)=CC(O)=C1O[Si](C)(C)C	3943.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #134	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	3977.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #135	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	3967.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #136	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	3946.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #137	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3993.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #138	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3963.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #139	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3991.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #14	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3890.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #140	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)C=C1O	3923.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #141	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)C=C1O	3939.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #142	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	3937.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #143	C[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4017.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #144	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	3961.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #145	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	3952.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #146	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	3924.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #147	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3951.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #148	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3929.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #149	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3956.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #15	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3842.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #150	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	3914.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #151	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3985.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #152	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3953.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #153	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3982.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #154	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	4014.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #16	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3975.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #17	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3927.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #18	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3870.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #19	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3920.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	3844.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #20	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3877.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #21	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3902.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #22	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3890.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #23	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3917.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #24	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3885.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #25	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3935.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #26	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3955.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #27	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3927.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #28	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3951.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #29	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3887.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3957.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #30	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3890.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #31	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3878.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #32	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3887.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #33	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	4003.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #34	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3999.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #35	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4009.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #36	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	4003.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #37	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4020.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #38	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4029.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #39	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4023.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3979.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #40	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4025.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #41	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3970.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #42	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3920.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #43	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4016.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #44	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3972.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #45	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3919.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #46	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3972.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #47	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3920.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #48	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3961.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #49	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3931.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3966.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #50	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4001.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #51	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3953.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #52	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3899.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #53	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3935.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #54	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3887.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #55	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3926.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #56	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3898.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #57	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3962.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #58	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3911.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #59	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3959.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3983.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #60	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3921.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #61	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3957.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #62	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3937.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #63	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3963.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #64	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3907.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3876.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3922.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #67	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3935.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #68	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3913.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #69	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3936.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #7	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3999.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #70	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3869.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #71	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3874.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #72	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3864.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #73	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3876.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #74	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3992.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #75	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3991.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #76	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	4001.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #77	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3994.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #78	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	4013.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #79	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	4023.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #8	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3995.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #80	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4006.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #81	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	3951.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #82	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	3904.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #83	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4014.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #84	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	3954.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #85	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	3904.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #86	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	4007.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #87	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3949.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #88	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3919.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #89	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3957.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #9	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3975.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #90	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3900.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #91	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	3934.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #92	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	3880.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #93	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	3992.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #94	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3909.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #95	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3886.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #96	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3921.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #97	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3867.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #98	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3942.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,4TMS,isomer #99	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3908.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #1	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3742.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #10	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3704.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #100	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3767.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #101	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3783.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #102	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3752.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #103	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3775.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #104	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3778.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #105	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3786.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #106	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3801.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #107	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3726.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #108	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3696.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #109	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3719.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #11	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3821.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #110	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3717.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #111	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3730.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #112	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3740.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #113	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3836.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #114	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3834.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #115	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3852.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #116	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3892.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #117	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O	3808.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #118	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O	3747.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #119	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C	3857.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #12	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3810.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #120	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3791.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #121	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3776.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #122	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3784.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #123	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3725.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #124	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3803.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #125	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3788.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #126	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3788.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #127	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3732.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #128	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3845.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #129	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3795.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #13	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3818.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #130	C[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3776.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #131	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O	3775.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #132	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3766.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #133	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3780.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #134	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C1O[Si](C)(C)C	3714.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #135	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3812.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #136	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3763.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #137	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3748.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #138	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O	3831.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #139	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3791.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #14	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3821.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #140	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3772.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #141	C[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C1O[Si](C)(C)C	3825.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #142	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3840.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #143	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3842.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #144	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3823.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #145	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3842.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #146	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3813.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #147	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3793.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #148	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3812.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #149	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3782.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #15	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3827.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #150	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3799.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #151	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3805.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #152	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3798.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #153	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3777.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #154	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3797.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #155	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3773.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #156	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3787.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #157	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3790.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #158	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3806.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #159	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3811.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #16	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3838.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #160	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3826.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #161	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3827.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #162	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3748.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #163	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3757.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #164	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3765.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #165	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3764.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #166	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3894.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #167	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O	3836.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #168	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O	3821.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #169	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C	3809.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #17	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3840.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #170	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3824.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #171	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3810.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #172	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3862.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #173	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3833.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #174	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3820.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #175	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3872.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #176	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3883.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #177	C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O	3780.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #178	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O	3809.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #179	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C	3799.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #18	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3821.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #180	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3850.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #181	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C)C3O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3856.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #182	C[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C	3867.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #19	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3764.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #2	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3730.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #20	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3704.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #21	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3824.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #22	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3767.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #23	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3713.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #24	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3765.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #25	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3713.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #26	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3763.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #27	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3754.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #28	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3808.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #29	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3751.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #3	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3746.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #30	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3690.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #31	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3732.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #32	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3675.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #33	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3729.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #34	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3718.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #35	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3778.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #36	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3723.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #37	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3769.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #38	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3757.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #39	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3768.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #4	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3761.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #40	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3751.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #41	C[Si](C)(C)OCC1OC(CO[Si](C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3795.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #42	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3821.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #43	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3790.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #44	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3789.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #45	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3769.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #46	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3784.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #47	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3780.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #48	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3783.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #49	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3756.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #5	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3739.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #50	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3777.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #51	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3807.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #52	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3783.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #53	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3803.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #54	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3790.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #55	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3800.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #56	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3814.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #57	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O	3754.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #58	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O	3726.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #59	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C	3746.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #6	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3760.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #60	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3726.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #61	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3741.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #62	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3750.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #63	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O	3854.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #64	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C	3857.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #65	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3872.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #66	C[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C	3904.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #67	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	3875.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #68	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3825.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #69	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3755.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #7	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3701.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #70	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3811.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #71	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3747.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #72	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3799.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #73	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3782.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #74	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3815.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #75	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3757.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #76	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3808.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #77	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3797.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #78	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3814.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #79	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3803.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #8	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3707.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #80	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3855.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #81	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C)=C1	3802.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #82	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O)=C1	3736.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #83	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3784.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #84	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3773.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #85	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3782.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #86	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3769.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #87	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3819.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #88	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C1	3813.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #89	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3801.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #9	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO[Si](C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3687.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #90	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3848.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #91	C[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C)C1OC(=O)C1=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C1	3851.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #92	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O	3805.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #93	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3766.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #94	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3778.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #95	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3759.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #96	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C	3776.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #97	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O[Si](C)(C)C)C(O)C(O)C1O	3748.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #98	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O[Si](C)(C)C)C(O)C1O	3770.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,5TMS,isomer #99	C[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C)C1O	3745.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4537.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4533.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4520.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C1O	4563.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C1O	4550.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)OC(CO)C(O)C1O	4562.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OC1C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(CO)OC1(CO)OC1OC(CO)C(O)C(O)C1O	4598.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O)=C1O	4520.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,1TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)C=C1O	4535.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4611.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4618.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4605.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4617.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4590.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C1O	4581.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C(C)(C)C	4639.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O	4566.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4560.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4629.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4616.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4608.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4607.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4598.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O)=CC(O)=C1O	4595.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O)C=C1O	4608.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C1O	4664.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C1O	4631.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C1O[Si](C)(C)C(C)(C)C	4641.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)=CC(O)=C1O	4586.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)C=C1O	4620.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C1O	4649.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4634.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	4644.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	4593.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)C=C1O	4589.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O	4666.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4637.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)C=C1O	4625.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4618.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4580.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4621.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4634.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4654.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4603.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4591.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,2TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4594.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #1	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O	4655.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #10	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4687.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #11	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4688.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #12	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4678.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #13	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4674.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #14	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4688.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #15	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4692.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #16	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4706.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #17	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4652.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #18	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4661.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #19	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4690.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #2	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4668.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #20	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4693.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #21	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4642.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #22	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4685.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #23	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4710.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #24	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4654.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #25	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4642.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #26	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4679.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #27	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4662.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #28	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4675.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #29	CC(C)(C)[Si](C)(C)OCC1OC(CO)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C1	4632.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #3	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4652.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #30	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O	4609.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #31	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4603.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #32	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4670.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #33	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4673.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #34	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4660.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #35	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4658.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #36	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4666.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #37	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4676.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #38	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4635.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #39	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C1O	4634.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #4	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C(O)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4676.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #40	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C(C)(C)C	4685.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #41	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O	4670.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #42	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4627.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #43	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C1O	4657.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #44	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C(C)(C)C	4670.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #45	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4638.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #46	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C1O	4622.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #47	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C(C)(C)C	4690.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #48	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4662.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #49	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)C1O	4620.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #5	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O[Si](C)(C)C(C)(C)C)C1OC(=O)C1=CC(O)=C(O)C(O)=C1	4680.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #50	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C1O[Si](C)(C)C(C)(C)C	4655.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #51	CC(C)(C)[Si](C)(C)OCC1(OC2OC(CO)C(O)C(O)C2O)OC(CO)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C1O[Si](C)(C)C(C)(C)C	4638.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #52	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O	4636.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #53	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O	4597.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #54	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4638.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #55	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4636.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #56	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4636.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #57	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4625.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #58	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O	4629.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #59	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4631.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #6	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C1	4630.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #60	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4683.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #61	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4630.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #62	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C1O	4695.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #63	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C1O	4685.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #64	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C(O)C1O[Si](C)(C)C(C)(C)C	4681.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #65	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4678.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #66	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4678.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #67	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4687.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #68	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)=CC(O)=C1O	4659.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #69	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	4652.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #7	CC(C)(C)[Si](C)(C)OCC1OC(CO[Si](C)(C)C(C)(C)C)(OC2OC(CO)C(O)C(O)C2O)C(O)C1OC(=O)C1=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C1	4622.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #70	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4668.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #71	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4678.7	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #72	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4645.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #73	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)C=C1O	4698.0	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #74	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)C=C1O	4674.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #75	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)C=C1O	4670.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #76	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O	4709.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #77	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C	4706.5	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #78	CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C	4699.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #79	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O	4657.1	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #8	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)C2O)C(O)C(O)C1O	4624.4	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #80	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4662.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #81	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4689.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #82	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4654.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #83	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O[Si](C)(C)C(C)(C)C)C2O)C=C1O	4687.8	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #84	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C3O)C2O[Si](C)(C)C(C)(C)C)C=C1O	4694.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #85	CC(C)(C)[Si](C)(C)OC1C(OC2(CO)OC(CO)C(OC(=O)C3=CC(O)=C(O)C(O)=C3)C2O[Si](C)(C)C(C)(C)C)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C	4703.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #86	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O	4671.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #87	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4666.9	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #88	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4631.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #89	CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C1O	4657.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #9	CC(C)(C)[Si](C)(C)OCC1OC(OC2(CO)OC(CO[Si](C)(C)C(C)(C)C)C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)C2O)C(O)C(O)C1O	4627.3	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #90	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C1O	4706.2	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #91	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O[Si](C)(C)C(C)(C)C	4661.6	Semi standard non polar	33892256
4'-O-Galloylsucrose,3TBDMS,isomer #92	CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(CO)OC(CO)(OC3OC(CO)C(O)C(O)C3O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C	4655.7	Semi standard non polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted GC-MS	Predicted GC-MS Spectrum - 4'-O-Galloylsucrose GC-MS (Non-derivatized) - 70eV, Positive	splash10-116r-5931800000-614a07a4ecbdf2c9bdfc	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 4'-O-Galloylsucrose GC-MS (2 TMS) - 70eV, Positive	splash10-0uk9-4901114000-9f35c7df86f90a698795	2017-10-06	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 4'-O-Galloylsucrose GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - 4'-O-Galloylsucrose GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 10V, Positive-QTOF	splash10-001i-0519000000-98a4ab7cedeeadf65ea3	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 20V, Positive-QTOF	splash10-03yi-0903000000-446ea78f1c7a55fe10f9	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 40V, Positive-QTOF	splash10-0wor-0921000000-ea2240bbd1a53419c44b	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 10V, Negative-QTOF	splash10-03di-2319200000-4d63860ea09aeed57749	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 20V, Negative-QTOF	splash10-03di-1908000000-7c2517835ccc6d753c22	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 40V, Negative-QTOF	splash10-016r-3932000000-541e1325bf406279d4a5	2016-08-03	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 10V, Negative-QTOF	splash10-01ox-0941500000-9db8bfa2db9d7cb376d5	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 20V, Negative-QTOF	splash10-05rs-2921500000-e0cb1df98af603d349f1	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 40V, Negative-QTOF	splash10-0a4i-9800100000-b94a5a09023095bf9e76	2021-09-22	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 10V, Positive-QTOF	splash10-0002-0002900000-be24d80fe3ce08a0f763	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 20V, Positive-QTOF	splash10-0072-0591000000-a5ce7b165b01e39aaf6f	2021-09-23	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - 4'-O-Galloylsucrose 40V, Positive-QTOF	splash10-0002-3944000000-91c7b99de667daa031e6	2021-09-23	Wishart Lab	View Spectrum

NMR Spectra

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

Biological Properties

Cellular Locations

Cytoplasm
Extracellular

Biospecimen Locations

Not Available

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Not Available

Abnormal Concentrations

Not Available

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

FDB018829

KNApSAcK ID

C00056522

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

14055553

PDB ID

Not Available

ChEBI ID

Not Available

Food Biomarker Ontology

Not Available

VMH ID

Not Available

MarkerDB ID

Not Available

Good Scents ID

Not Available

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

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

Showing metabocard for 4'-O-Galloylsucrose (HMDB0039284)

MOL for HMDB0039284 (4'-O-Galloylsucrose)

3D MOL for HMDB0039284 (4'-O-Galloylsucrose)

3D SDF for HMDB0039284 (4'-O-Galloylsucrose)

3D-SDF for HMDB0039284 (4'-O-Galloylsucrose)

PDB for HMDB0039284 (4'-O-Galloylsucrose)

3D PDB for HMDB0039284 (4'-O-Galloylsucrose)

SMILES for HMDB0039284 (4'-O-Galloylsucrose)

INCHI for HMDB0039284 (4'-O-Galloylsucrose)

Structure for HMDB0039284 (4'-O-Galloylsucrose)

3D Structure for HMDB0039284 (4'-O-Galloylsucrose)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra