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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-12 00:32:52 UTC
Update Date2022-03-07 02:56:06 UTC
HMDB IDHMDB0039178
Secondary Accession Numbers
  • HMDB39178
Metabolite Identification
Common Name1,2-Digalloyl-beta-D-glucopyranose
Description1,2-Digalloyl-beta-D-glucopyranose belongs to the class of organic compounds known as tannins. These are naturally occurring polyphenols which be categorized into four main classes: hydrolyzable tannin (based on ellagic acid or gallic acid), condensed tannins (made of oligomeric or polymeric proanthocyanidins), complex tannins (made of a catechin bound to a gallotannin or elagitannin), and phlorotannins (oligomers of phloroglucinol). 1,2-Digalloyl-beta-D-glucopyranose has been detected, but not quantified in, green vegetables. This could make 1,2-digalloyl-beta-D-glucopyranose a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on 1,2-Digalloyl-beta-D-glucopyranose.
Structure
Data?1563863327
Synonyms
ValueSource
1,2-Digalloyl-b-D-glucopyranoseGenerator
1,2-Digalloyl-β-D-glucopyranoseGenerator
4,5-Dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl 3,4,5-trihydroxybenzoic acidHMDB
Chemical FormulaC20H20O14
Average Molecular Weight484.3644
Monoisotopic Molecular Weight484.085305348
IUPAC Name4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl 3,4,5-trihydroxybenzoate
Traditional Name4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl 3,4,5-trihydroxybenzoate
CAS Registry Number115713-50-3
SMILES
OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O
InChI Identifier
InChI=1S/C20H20O14/c21-5-12-15(28)16(29)17(33-18(30)6-1-8(22)13(26)9(23)2-6)20(32-12)34-19(31)7-3-10(24)14(27)11(25)4-7/h1-4,12,15-17,20-29H,5H2
InChI KeyFNEQBVHIJSMWKC-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as tannins. These are naturally occurring polyphenols which be categorized into four main classes: Hydrolyzable tannin (based on ellagic acid or gallic acid), condensed tannins (made of oligomeric or polymeric proanthocyanidins), complex tannins (made of a catechin bound to a gallotannin or elagitannin), and phlorotannins (oligomers of phloroglucinol).
KingdomOrganic compounds
Super ClassPhenylpropanoids and polyketides
ClassTannins
Sub ClassNot Available
Direct ParentTannins
Alternative Parents
Substituents
  • Tannin
  • Galloyl ester
  • Hexose monosaccharide
  • Gallic acid or derivatives
  • P-hydroxybenzoic acid alkyl ester
  • M-hydroxybenzoic acid ester
  • P-hydroxybenzoic acid ester
  • Benzoate ester
  • Benzenetriol
  • Benzoic acid or derivatives
  • Pyrogallol derivative
  • Benzoyl
  • 1-hydroxy-4-unsubstituted benzenoid
  • 1-hydroxy-2-unsubstituted benzenoid
  • Phenol
  • Monocyclic benzene moiety
  • Monosaccharide
  • Dicarboxylic acid or derivatives
  • Oxane
  • Benzenoid
  • Secondary alcohol
  • Carboxylic acid ester
  • Acetal
  • Oxacycle
  • Organoheterocyclic compound
  • Carboxylic acid derivative
  • Polyol
  • Alcohol
  • Hydrocarbon derivative
  • Organic oxygen compound
  • Primary alcohol
  • Organic oxide
  • Organooxygen compound
  • Aromatic heteromonocyclic compound
Molecular FrameworkAromatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
Role
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point169 - 170 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility2.49 g/LALOGPS
logP0.76ALOGPS
logP0.24ChemAxon
logS-2.3ALOGPS
pKa (Strongest Acidic)7.79ChemAxon
pKa (Strongest Basic)-3.6ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count12ChemAxon
Hydrogen Donor Count9ChemAxon
Polar Surface Area243.9 ŲChemAxon
Rotatable Bond Count7ChemAxon
Refractivity107.45 m³·mol⁻¹ChemAxon
Polarizability44.83 ųChemAxon
Number of Rings3ChemAxon
BioavailabilityNoChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleYesChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+209.50731661259
DarkChem[M-H]-201.88131661259
DeepCCS[M+H]+201.1430932474
DeepCCS[M-H]-198.74530932474
DeepCCS[M-2H]-231.62830932474
DeepCCS[M+Na]+207.05330932474
AllCCS[M+H]+205.032859911
AllCCS[M+H-H2O]+203.032859911
AllCCS[M+NH4]+206.832859911
AllCCS[M+Na]+207.332859911
AllCCS[M-H]-199.232859911
AllCCS[M+Na-2H]-199.732859911
AllCCS[M+HCOO]-200.432859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
1,2-Digalloyl-beta-D-glucopyranoseOCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O5837.1Standard polar33892256
1,2-Digalloyl-beta-D-glucopyranoseOCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4539.1Standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranoseOCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4452.5Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #1C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4549.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #2C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4586.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #3C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4511.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #4C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4588.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #5C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)C=C1O4512.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #6C[Si](C)(C)OC1C(O)C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1OC(=O)C1=CC(O)=C(O)C(O)=C14596.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TMS,isomer #7C[Si](C)(C)OC1C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O4562.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #1C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4434.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #10C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O4304.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #11C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4452.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #12C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4348.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #13C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4363.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #14C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4384.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #15C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4306.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #16C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C=C1O4254.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #17C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O4428.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #18C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O4460.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #19C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O4452.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #2C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4389.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #20C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O[Si](C)(C)C4347.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #21C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)C=C1O4361.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #22C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)C=C1O4382.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #23C[Si](C)(C)OC1C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C4475.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #3C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4435.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #4C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O4387.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #5C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4489.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #6C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4529.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #7C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4428.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #8C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4459.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TMS,isomer #9C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4407.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #1C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4302.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #10C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4353.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #11C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4301.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #12C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O4248.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #13C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4321.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #14C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4396.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #15C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O4287.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #16C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C4351.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #17C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4459.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #18C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4304.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #19C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4203.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #2C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4250.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #20C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O4117.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #21C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4281.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #22C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4230.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #23C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4205.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #24C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O4112.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #25C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4286.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #26C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4230.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #27C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4165.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #28C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4114.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #29C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4166.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #3C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4235.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #30C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4116.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #31C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4096.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #32C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4051.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #33C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4251.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #34C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4258.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #35C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O4118.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #36C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C=C1O4124.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #37C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O4113.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #38C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C=C1O4132.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #39C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O4096.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #4C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O4163.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #40C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O[Si](C)(C)C4050.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #41C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O4304.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #42C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O4282.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #43C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C4228.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #44C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O4287.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #45C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C4228.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #46C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4251.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #47C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C1O4257.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #5C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4321.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #6C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4396.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #7C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4163.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #8C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O4127.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TMS,isomer #9C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4289.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #1C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4184.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #10C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4074.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #11C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O4042.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #12C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4111.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #13C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4178.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #14C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O4040.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #15C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C4105.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #16C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4318.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #17C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4028.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #18C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O4000.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #19C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4040.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #2C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4074.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #20C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4105.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #21C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O4062.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #22C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C4108.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #23C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4260.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #24C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O4182.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #25C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4216.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #26C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4273.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #27C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4178.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #28C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4234.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #29C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4317.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #3C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O4027.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #30C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4259.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #31C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4099.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #32C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O4032.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #33C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4205.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #34C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4165.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #35C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4052.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #36C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4027.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #37C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O4052.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #38C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O4029.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #39C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4037.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #4C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4217.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #40C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4028.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #41C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4190.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #42C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4037.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #43C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4010.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #44C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O4037.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #45C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O4013.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #46C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O4034.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #47C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O[Si](C)(C)C4024.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #48C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4180.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #49C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O4062.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #5C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4274.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #50C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O4024.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #51C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O3995.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #52C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O3993.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #53C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O[Si](C)(C)C3964.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #54C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4064.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #55C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3999.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #56C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O4032.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #57C[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C=C1O4037.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #58C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O4037.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #59C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C4026.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #6C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O4043.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #60C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O4035.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #61C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C4023.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #62C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3999.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #63C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O4204.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #64C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C4164.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #65C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4189.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #66C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4179.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #7C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O4002.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #8C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4181.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,4TMS,isomer #9C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4237.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #1C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O3984.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #10C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C4050.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #11C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4190.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #12C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O3960.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #13C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O3926.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #14C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O3973.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #15C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4027.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #16C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O3996.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #17C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C4030.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #18C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4163.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #19C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O3980.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #2C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O)C1O3948.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #20C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O3988.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #21C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4054.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #22C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O3971.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #23C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4025.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #24C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4111.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #25C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4044.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #26C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O3947.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #27C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4010.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #28C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4051.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #29C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O3995.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #3C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C)C1O4100.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #30C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4029.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #31C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4044.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #32C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4054.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #33C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O4098.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #34C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4167.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #35C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4189.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #36C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C4161.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #37C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O)=C1O3984.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #38C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O3969.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #39C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O3983.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #4C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C4168.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #40C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O3971.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #41C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O3979.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #42C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O)=C1O[Si](C)(C)C3974.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #43C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4105.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #44C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O3992.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #45C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O4004.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #46C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O3985.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #47C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O3984.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #48C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O[Si](C)(C)C3959.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #49C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O)=C1O3994.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #5C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O3991.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #50C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3984.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #51C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O3968.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #52C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O3984.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #53C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O3972.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #54C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O3969.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #55C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O[Si](C)(C)C3946.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #56C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O)=C1O3970.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #57C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3968.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #58C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O[Si](C)(C)C)=C1O3967.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #59C[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)=CC(O)=C1O[Si](C)(C)C3936.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #6C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C2)C(O)C1O3958.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #60C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C)=C1O3969.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #61C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C)=C(O[Si](C)(C)C)C(O[Si](C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O[Si](C)(C)C3936.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #62C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O3980.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #63C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O)=C1O[Si](C)(C)C3973.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #64C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3982.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #65C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C3966.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #66C[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(O[Si](C)(C)C)=C1O[Si](C)(C)C4104.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #7C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O[Si](C)(C)C)C1O3986.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #8C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C)=C2)C(O)C1O[Si](C)(C)C4053.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,5TMS,isomer #9C[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C)=C(O)C(O[Si](C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C)C(O)=C2)C(O[Si](C)(C)C)C1O4008.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4840.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4832.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4801.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4833.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)C=C1O4800.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1OC(=O)C1=CC(O)=C(O)C(O)=C14865.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O4834.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4866.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)=CC(O)=C1O4776.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C(C)(C)C)=C1O4849.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C(C)(C)C4792.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4826.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4840.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4778.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C=C1O4813.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O4857.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O4872.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O4848.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4838.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C4790.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)C=C1O4824.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)C=C1O4838.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1C(CO)OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C1O[Si](C)(C)C(C)(C)C4941.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C1O4866.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C1O4837.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O4937.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C(C)(C)C4988.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4857.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4871.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)=CC(O)=C1O4805.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4917.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C(C)(C)C4930.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)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)C(O)C1O4915.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)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)C(O)C1O4870.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O[Si](C)(C)C(C)(C)C)C1O4919.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C1O[Si](C)(C)C(C)(C)C4962.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O4892.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C1O[Si](C)(C)C(C)(C)C4929.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C5071.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O4888.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)=CC(O)=C1O4833.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O4874.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)=CC(O)=C1O4819.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C(C)(C)C)=C1O4891.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C(C)(C)C4850.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)=CC(O)=C1O4837.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)=CC(O)=C1O4828.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C(C)(C)C)=C1O4889.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O)=C1O[Si](C)(C)C(C)(C)C4849.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)=CC(O)=C1O4836.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C2)=CC(O)=C1O4799.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O[Si](C)(C)C(C)(C)C)=C(O)C(O[Si](C)(C)C(C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4837.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C1O4859.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)=C3)OC(CO)C(O)C2O)=CC(O)=C1O4801.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)=CC(O[Si](C)(C)C(C)(C)C)=C1O4885.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)=CC(O)=C1O[Si](C)(C)C(C)(C)C4850.2Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2OC(CO)C(O)C(O)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C4868.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O)C(O)=C2)C=C1O4861.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O4821.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #36CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C=C1O4916.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #37CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O4829.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #38CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C=C1O4938.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #39CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O4886.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C1O4830.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #40CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C3)OC(CO)C(O)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C4849.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #41CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O4889.1Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #42CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O4889.7Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #43CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(O)=C1O[Si](C)(C)C(C)(C)C4847.9Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #44CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O[Si](C)(C)C(C)(C)C)=C1O4888.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #45CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(O)=C1O[Si](C)(C)C(C)(C)C4847.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #46CC(C)(C)[Si](C)(C)OC1=CC(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O)C2O)=CC(O[Si](C)(C)C(C)(C)C)=C1O[Si](C)(C)C(C)(C)C4866.4Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #47CC(C)(C)[Si](C)(C)OC1=C(O)C=C(C(=O)OC2C(OC(=O)C3=CC(O)=C(O)C(O)=C3)OC(CO)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C1O4859.5Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O4919.3Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O)C1O[Si](C)(C)C(C)(C)C4962.8Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O[Si](C)(C)C(C)(C)C)=C2)C(O)C1O4830.6Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(O)C1O4890.0Semi standard non polar33892256
1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC1OC(OC(=O)C2=CC(O)=C(O[Si](C)(C)C(C)(C)C)C(O)=C2)C(OC(=O)C2=CC(O)=C(O)C(O)=C2)C(O[Si](C)(C)C(C)(C)C)C1O4894.0Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose GC-MS (Non-derivatized) - 70eV, Positivesplash10-0uxr-6924300000-4f2076c0565695ba54652017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose GC-MS (2 TMS) - 70eV, Positivesplash10-0w29-2911103000-ae9bf1e53e5fcee6574e2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose GC-MS (TBDMS_3_23) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose GC-MS ("1,2-Digalloyl-beta-D-glucopyranose,3TBDMS,#23" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 10V, Positive-QTOFsplash10-0gbi-0917700000-de8a9c0befaeff438da82016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 20V, Positive-QTOFsplash10-0uxr-0913200000-dfbaffbf38d2c7b051462016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 40V, Positive-QTOFsplash10-0udi-2900000000-eaf0c27d4cdf6c8edde32016-08-02Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 10V, Negative-QTOFsplash10-00lr-0927800000-50bb2627a2fc4b6de9202016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 20V, Negative-QTOFsplash10-014i-0912100000-dbcf1eae0ab79ad33aaf2016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 40V, Negative-QTOFsplash10-016r-1900000000-b15eed994fa2b98c94022016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 10V, Negative-QTOFsplash10-001i-0105900000-1f7b0b3bedc44e8481cb2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 20V, Negative-QTOFsplash10-07xr-1974200000-012550fe5ede5e86aebb2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 40V, Negative-QTOFsplash10-00or-2900100000-3bf5219cb268aacf48b42021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 10V, Positive-QTOFsplash10-0002-0193100000-274e76327016ec5858ea2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 20V, Positive-QTOFsplash10-0udr-2900000000-d03593f8395f154c122e2021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 1,2-Digalloyl-beta-D-glucopyranose 40V, Positive-QTOFsplash10-0udi-5900200000-9bdf5dd450b798658efa2021-09-22Wishart LabView Spectrum
Biological Properties
Cellular Locations
  • Cytoplasm
  • Extracellular
Biospecimen LocationsNot Available
Tissue LocationsNot Available
Pathways
Normal Concentrations
Not Available
Abnormal Concentrations
Not Available
Associated Disorders and Diseases
Disease ReferencesNone
Associated OMIM IDsNone
DrugBank IDNot Available
Phenol Explorer Compound IDNot Available
FooDB IDFDB018706
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound14034255
PDB IDNot Available
ChEBI IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
MarkerDB IDNot Available
Good Scents IDNot Available
References
Synthesis ReferenceNot Available
Material Safety Data Sheet (MSDS)Not Available
General References
  1. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .

Enzymes

General function:
Involved in transferase activity, transferring hexosyl groups
Specific function:
UDPGT is of major importance in the conjugation and subsequent elimination of potentially toxic xenobiotics and endogenous compounds. This isoform glucuronidates bilirubin IX-alpha to form both the IX-alpha-C8 and IX-alpha-C12 monoconjugates and diconjugate. Is also able to catalyze the glucuronidation of 17beta-estradiol, 17alpha-ethinylestradiol, 1-hydroxypyrene, 4-methylumbelliferone, 1-naphthol, paranitrophenol, scopoletin, and umbelliferone.
Gene Name:
UGT1A1
Uniprot ID:
P22309
Molecular weight:
59590.91
Reactions
1,2-Digalloyl-beta-D-glucopyranose → 6-[5-({[4,5-dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl]oxy}carbonyl)-2,3-dihydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic aciddetails
1,2-Digalloyl-beta-D-glucopyranose → 6-[4-({[4,5-dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl]oxy}carbonyl)-2,6-dihydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic aciddetails
1,2-Digalloyl-beta-D-glucopyranose → 6-[5-({[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy}carbonyl)-2,3-dihydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic aciddetails
1,2-Digalloyl-beta-D-glucopyranose → 6-[4-({[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy}carbonyl)-2,6-dihydroxyphenoxy]-3,4,5-trihydroxyoxane-2-carboxylic aciddetails
General function:
Lipid transport and metabolism
Specific function:
Involved in the detoxification of xenobiotics and in the activation of ester and amide prodrugs. Hydrolyzes aromatic and aliphatic esters, but has no catalytic activity toward amides or a fatty acyl-CoA ester. Hydrolyzes the methyl ester group of cocaine to form benzoylecgonine. Catalyzes the transesterification of cocaine to form cocaethylene. Displays fatty acid ethyl ester synthase activity, catalyzing the ethyl esterification of oleic acid to ethyloleate.
Gene Name:
CES1
Uniprot ID:
P23141
Molecular weight:
62520.62
Reactions
1,2,4-Trigalloyl-beta-D-glucopyranose → 1,2-Digalloyl-beta-D-glucopyranosedetails
1,2-Digalloyl-beta-D-glucopyranose → 2-Galloylglucosedetails
General function:
sulfotransferase activity
Specific function:
Sulfotransferase that utilizes 3'-phospho-5'-adenylyl sulfate (PAPS) as sulfonate donor to catalyze the sulfate conjugation of phenolic monoamines (neurotransmitters such as dopamine, norepinephrine and serotonin) and phenolic and catechol drugs.
Gene Name:
SULT1A3
Uniprot ID:
P0DMM9
Molecular weight:
34195.96
Reactions
1,2-Digalloyl-beta-D-glucopyranose → [4-({[4,5-dihydroxy-6-(hydroxymethyl)-2-(3,4,5-trihydroxybenzoyloxy)oxan-3-yl]oxy}carbonyl)-2,6-dihydroxyphenyl]oxidanesulfonic aciddetails
1,2-Digalloyl-beta-D-glucopyranose → [4-({[4,5-dihydroxy-6-(hydroxymethyl)-3-(3,4,5-trihydroxybenzoyloxy)oxan-2-yl]oxy}carbonyl)-2,6-dihydroxyphenyl]oxidanesulfonic aciddetails