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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-12 02:09:41 UTC
Update Date2022-03-07 02:56:39 UTC
HMDB IDHMDB0040602
Secondary Accession Numbers
  • HMDB40602
Metabolite Identification
Common Name(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside
Description(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol. Based on a literature review a small amount of articles have been published on (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside.
Structure
Data?1563863567
Synonyms
ValueSource
(1XI,2xi)-1-(4-hydroxyphenyl)-1,2,3-propanetriol 3-O-b-D-glucopyranosideGenerator
(1XI,2xi)-1-(4-hydroxyphenyl)-1,2,3-propanetriol 3-O-β-D-glucopyranosideGenerator
Chemical FormulaC15H22O9
Average Molecular Weight346.3298
Monoisotopic Molecular Weight346.126382302
IUPAC Name2-[2,3-dihydroxy-3-(4-hydroxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
Traditional Name2-[2,3-dihydroxy-3-(4-hydroxyphenyl)propoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
CAS Registry Number67151-73-9
SMILES
OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O
InChI Identifier
InChI=1S/C15H22O9/c16-5-10-12(20)13(21)14(22)15(24-10)23-6-9(18)11(19)7-1-3-8(17)4-2-7/h1-4,9-22H,5-6H2
InChI KeyPUGXDKPZBZICDX-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as fatty acyl glycosides of mono- and disaccharides. Fatty acyl glycosides of mono- and disaccharides are compounds composed of a mono- or disaccharide moiety linked to one hydroxyl group of a fatty alcohol or of a phosphorylated alcohol (phosphoprenols), a hydroxy fatty acid or to one carboxyl group of a fatty acid (ester linkage) or to an amino alcohol.
KingdomOrganic compounds
Super ClassLipids and lipid-like molecules
ClassFatty Acyls
Sub ClassFatty acyl glycosides
Direct ParentFatty acyl glycosides of mono- and disaccharides
Alternative Parents
Substituents
  • Fatty acyl glycoside of mono- or disaccharide
  • Alkyl glycoside
  • Hexose monosaccharide
  • Glycosyl compound
  • O-glycosyl compound
  • 1-hydroxy-2-unsubstituted benzenoid
  • Phenol
  • Monocyclic benzene moiety
  • Monosaccharide
  • Benzenoid
  • Oxane
  • Secondary alcohol
  • Organoheterocyclic compound
  • Oxacycle
  • Acetal
  • Polyol
  • Organooxygen compound
  • Organic oxygen compound
  • Alcohol
  • Hydrocarbon derivative
  • Aromatic alcohol
  • Primary alcohol
  • Aromatic heteromonocyclic compound
Molecular FrameworkAromatic heteromonocyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
Process
Role
Physical Properties
StateNot Available
Experimental Molecular Properties
PropertyValueReference
Melting PointNot AvailableNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility21.5 g/LALOGPS
logP-1.8ALOGPS
logP-2.1ChemAxon
logS-1.2ALOGPS
pKa (Strongest Acidic)9.47ChemAxon
pKa (Strongest Basic)-3ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count9ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area160.07 ŲChemAxon
Rotatable Bond Count6ChemAxon
Refractivity79.19 m³·mol⁻¹ChemAxon
Polarizability34.05 ųChemAxon
Number of Rings2ChemAxon
BioavailabilityYesChemAxon
Rule of FiveNoChemAxon
Ghose FilterNoChemAxon
Veber's RuleNoChemAxon
MDDR-like RuleNoChemAxon
Predicted Chromatographic Properties

Predicted Collision Cross Sections

PredictorAdduct TypeCCS Value (Å2)Reference
DarkChem[M+H]+177.94331661259
DarkChem[M-H]-174.07831661259
DeepCCS[M+H]+175.54130932474
DeepCCS[M-H]-173.18330932474
DeepCCS[M-2H]-206.95530932474
DeepCCS[M+Na]+182.18230932474
AllCCS[M+H]+181.932859911
AllCCS[M+H-H2O]+178.932859911
AllCCS[M+NH4]+184.632859911
AllCCS[M+Na]+185.432859911
AllCCS[M-H]-177.632859911
AllCCS[M+Na-2H]-177.832859911
AllCCS[M+HCOO]-178.132859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-GlucopyranosideOCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O4750.9Standard polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-GlucopyranosideOCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3490.6Standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-GlucopyranosideOCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3236.5Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3219.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #2C[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O)C(O)C1=CC=C(O)C=C13226.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #3C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O)C1O3249.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #4C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O)C2O)C=C13253.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #5C[Si](C)(C)OC1C(OCC(O)C(O)C2=CC=C(O)C=C2)OC(CO)C(O)C1O3219.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #6C[Si](C)(C)OC1C(O)C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C1O3207.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TMS,isomer #7C[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C1O3222.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3157.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #10C[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O)C(O[Si](C)(C)C)C1=CC=C(O)C=C13208.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #11C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O)C2O)O[Si](C)(C)C)C=C13220.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #12C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O)C(O)C2O)C=C13188.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #13C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O3149.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #14C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O3120.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #15C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C3151.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #16C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C=C13162.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #17C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C=C13131.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #18C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C=C13151.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #19C[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C1O3115.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #2C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O3169.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #20C[Si](C)(C)OC1C(OCC(O)C(O)C2=CC=C(O)C=C2)OC(CO)C(O)C1O[Si](C)(C)C3138.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #21C[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C1O[Si](C)(C)C3127.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #3C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O3181.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #4C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O3146.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #5C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O3129.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #6C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C3144.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #7C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(O)C1=CC=C(O)C=C13137.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #8C[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(O)C1=CC=C(O)C=C13113.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TMS,isomer #9C[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(O)C1=CC=C(O)C=C13137.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O3108.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #10C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O3081.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #11C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O3054.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #12C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C3080.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #13C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3077.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #14C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3109.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #15C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3074.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #16C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(O)C1=CC=C(O)C=C13052.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #17C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(O)C1=CC=C(O)C=C13055.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #18C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(O[Si](C)(C)C)C1=CC=C(O)C=C13105.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #19C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C=C13084.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #2C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O3096.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #20C[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(O)C1=CC=C(O)C=C13065.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #21C[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(O[Si](C)(C)C)C1=CC=C(O)C=C13076.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #22C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C=C13073.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #23C[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(O[Si](C)(C)C)C1=CC=C(O)C=C13106.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #24C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C13075.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #25C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O)C(O)C2O)O[Si](C)(C)C)C=C13097.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #26C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)C=C13058.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #27C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)C=C13043.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #28C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)C=C13046.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #29C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3051.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #3C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O3081.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #30C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3056.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #31C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3065.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #32C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=C13056.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #33C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=C13052.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #34C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C13068.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #35C[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C1O[Si](C)(C)C3076.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #4C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O3045.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #5C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C3080.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #6C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O3063.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #7C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O3084.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #8C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O3041.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TMS,isomer #9C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C3080.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O3010.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #10C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3032.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #11C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O3024.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #12C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O2997.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #13C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C3026.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #14C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3025.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #15C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3068.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #16C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3020.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #17C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3051.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #18C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3075.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #19C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3050.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #2C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O3054.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #20C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3112.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #21C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(O)C1=CC=C(O)C=C13027.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #22C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(O[Si](C)(C)C)C1=CC=C(O)C=C13032.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #23C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C=C13045.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #24C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(O[Si](C)(C)C)C1=CC=C(O)C=C13047.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #25C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C13049.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #26C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)O[Si](C)(C)C)C=C13021.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #27C[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(O[Si](C)(C)C)C1=CC=C(O)C=C13036.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #28C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C13047.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #29C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C=C12983.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #3C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O2989.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #30C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C13011.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #31C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)C=C13003.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #32C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)C=C13016.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #33C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C13009.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #34C[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3031.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #35C[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C13046.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #4C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C3052.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #5C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O3055.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #6C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O3033.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #7C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C3058.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #8C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3034.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TMS,isomer #9C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3086.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O2991.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #10C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3103.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #11C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O2987.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #12C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3036.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #13C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C2994.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #14C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3090.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #15C[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3101.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #16C[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(O[Si](C)(C)C)C1=CC=C(O)C=C13009.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #17C[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C13018.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #18C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)O[Si](C)(C)C)C=C12965.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #19C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C12980.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #2C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O2953.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #20C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C12958.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #21C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)C=C12974.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #3C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C2993.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #4C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O2999.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #5C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3068.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #6C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3001.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #7C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O3034.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #8C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3079.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,5TMS,isomer #9C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C3038.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O2983.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #2C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C3024.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #3C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C2987.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #4C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3013.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #5C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3049.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #6C[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3028.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,6TMS,isomer #7C[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C)C(COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)O[Si](C)(C)C)C=C12952.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,7TMS,isomer #1C[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C2=CC=C(O[Si](C)(C)C)C=C2)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C3014.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3449.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #2CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O)C(O)C1=CC=C(O)C=C13467.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #3CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O)C1O3478.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #4CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O)C2O)C=C13477.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #5CC(C)(C)[Si](C)(C)OC1C(OCC(O)C(O)C2=CC=C(O)C=C2)OC(CO)C(O)C1O3458.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #6CC(C)(C)[Si](C)(C)OC1C(O)C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C1O3453.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,1TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C1O3468.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O3603.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #10CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13653.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #11CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O)C2O)O[Si](C)(C)C(C)(C)C)C=C13696.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #12CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O)C(O)C2O)C=C13662.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #13CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3624.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #14CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3584.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #15CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3601.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C=C13658.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C=C13630.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C=C13631.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C1O3590.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O3627.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC1C(OCC(O)C(O)C2=CC=C(O)C=C2)OC(CO)C(O)C1O[Si](C)(C)C(C)(C)C3598.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C1O[Si](C)(C)C(C)(C)C3580.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O3650.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3585.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3574.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3593.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #7CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(O)C1=CC=C(O)C=C13620.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #8CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(O)C1=CC=C(O)C=C13597.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,2TBDMS,isomer #9CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(O)C1=CC=C(O)C=C13602.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O3719.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3767.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3786.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3792.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O3703.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C3720.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3701.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #16CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O)C(O)C1=CC=C(O)C=C13690.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #17CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C)C(O)C1=CC=C(O)C=C13690.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #18CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13722.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #19CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)O[Si](C)(C)C(C)(C)C)C=C13827.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O3801.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #20CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)C(O)C1=CC=C(O)C=C13709.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13698.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)O[Si](C)(C)C(C)(C)C)C=C13816.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13690.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C=C13799.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(COC2OC(CO)C(O)C(O)C2O)O[Si](C)(C)C(C)(C)C)C=C13801.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)C=C13811.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)C=C13800.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)C=C13774.2Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O3705.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3688.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C3697.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3716.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C=C13784.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C=C13778.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C13795.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1C(CO)OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3702.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3692.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3712.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O3784.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3695.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3712.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,3TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3729.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #1CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O3896.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #10CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3841.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #11CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3925.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #12CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3959.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #13CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3948.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #14CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O3870.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #15CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C3901.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #16CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3867.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #17CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O3959.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #18CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C3973.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #19CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3961.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #2CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3817.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #20CC(C)(C)[Si](C)(C)OCC1OC(OCC(O)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3880.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #21CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)C(O)C1=CC=C(O)C=C13827.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #22CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13821.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #23CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)O[Si](C)(C)C(C)(C)C)C=C13956.3Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #24CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13820.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #25CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C=C13955.4Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #26CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)O[Si](C)(C)C(C)(C)C)C=C13920.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #27CC(C)(C)[Si](C)(C)OC(COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1=CC=C(O)C=C13832.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #28CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C=C13971.9Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #29CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)O[Si](C)(C)C(C)(C)C)C=C13923.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #3CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3833.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #30CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)O[Si](C)(C)C(C)(C)C)C=C13900.8Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #31CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)C=C13956.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #32CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)C=C13945.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #33CC(C)(C)[Si](C)(C)OC1=CC=C(C(O[Si](C)(C)C(C)(C)C)C(O)COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C13962.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #34CC(C)(C)[Si](C)(C)OC(C1=CC=C(O)C=C1)C(O)COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O[Si](C)(C)C(C)(C)C3844.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #35CC(C)(C)[Si](C)(C)OC1=CC=C(C(O)C(O)COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)C=C13950.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #4CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2=CC=C(O)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3845.0Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #5CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O3937.5Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #6CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O[Si](C)(C)C(C)(C)C)C1O3964.6Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #7CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O[Si](C)(C)C(C)(C)C)C=C2)C(O)C(O)C1O[Si](C)(C)C(C)(C)C3956.1Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #8CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C1O3840.7Semi standard non polar33892256
(1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside,4TBDMS,isomer #9CC(C)(C)[Si](C)(C)OCC1OC(OCC(O[Si](C)(C)C(C)(C)C)C(O)C2=CC=C(O)C=C2)C(O[Si](C)(C)C(C)(C)C)C(O)C1O[Si](C)(C)C(C)(C)C3872.4Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside GC-MS (Non-derivatized) - 70eV, Positivesplash10-00fr-2913000000-557a67f5f827c371f2132017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside GC-MS (4 TMS) - 70eV, Positivesplash10-014i-2390026000-5a5be2df0e3d66e7ba132017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside GC-MS (Non-derivatized) - 70eV, PositiveNot Available2021-10-12Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 10V, Positive-QTOFsplash10-002b-0509000000-cce52f5f2316a80fc3312017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 20V, Positive-QTOFsplash10-030a-1902000000-b13bc005727ef7ffdc5a2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 40V, Positive-QTOFsplash10-08i4-6910000000-046c1597cc6849ecb7732017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 10V, Negative-QTOFsplash10-002b-2908000000-101b8f66bfdb3798066d2017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 20V, Negative-QTOFsplash10-01xx-6902000000-6025fabd5caa6b88d4c32017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 40V, Negative-QTOFsplash10-0k96-9600000000-29a1715361d3af322d832017-09-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 10V, Negative-QTOFsplash10-002b-0309000000-f04b673997dd0eb903102021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 20V, Negative-QTOFsplash10-0a4l-5912000000-dadf77491a35a1e4bfe32021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 40V, Negative-QTOFsplash10-0006-9600000000-50ca82b2866d284a78d42021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 10V, Positive-QTOFsplash10-002b-0509000000-0b97be5d582ed3162d332021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 20V, Positive-QTOFsplash10-014j-1911000000-779b2b21cced1f42f21a2021-09-25Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (1xi,2xi)-1-(4-Hydroxyphenyl)-1,2,3-propanetriol 3-O-beta-D-Glucopyranoside 40V, Positive-QTOFsplash10-052b-7900000000-0330f0d53907c6f274dd2021-09-25Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR1H NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 1000 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 200 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 300 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 400 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 500 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 600 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 700 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart 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 IDFDB020390
KNApSAcK IDNot Available
Chemspider IDNot Available
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound131752861
PDB IDNot Available
ChEBI ID175372
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. Simons K, Toomre D: Lipid rafts and signal transduction. Nat Rev Mol Cell Biol. 2000 Oct;1(1):31-9. [PubMed:11413487 ]
  2. Watson AD: Thematic review series: systems biology approaches to metabolic and cardiovascular disorders. Lipidomics: a global approach to lipid analysis in biological systems. J Lipid Res. 2006 Oct;47(10):2101-11. Epub 2006 Aug 10. [PubMed:16902246 ]
  3. Sethi JK, Vidal-Puig AJ: Thematic review series: adipocyte biology. Adipose tissue function and plasticity orchestrate nutritional adaptation. J Lipid Res. 2007 Jun;48(6):1253-62. Epub 2007 Mar 20. [PubMed:17374880 ]
  4. Lingwood D, Simons K: Lipid rafts as a membrane-organizing principle. Science. 2010 Jan 1;327(5961):46-50. doi: 10.1126/science.1174621. [PubMed:20044567 ]
  5. (). Yannai, Shmuel. (2004) Dictionary of food compounds with CD-ROM: Additives, flavors, and ingredients. Boca Raton: Chapman & Hall/CRC.. .
  6. Gunstone, Frank D., John L. Harwood, and Albert J. Dijkstra (2007). The lipid handbook with CD-ROM. CRC Press.