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Record Information
Version5.0
StatusExpected but not Quantified
Creation Date2012-09-12 00:16:14 UTC
Update Date2022-03-07 02:55:59 UTC
HMDB IDHMDB0038922
Secondary Accession Numbers
  • HMDB38922
Metabolite Identification
Common Name(7'R)-(+)-Lyoniresinol 9'-glucoside
Description(7'R)-(+)-Lyoniresinol 9'-glucoside belongs to the class of organic compounds known as lignan glycosides. These are aromatic polycyclic compounds containing a carbohydrate component glycosidically linked to a lignan moiety. They include 1-aryltetralin lactones (7'R)-(+)-Lyoniresinol 9'-glucoside has been detected, but not quantified in, fruits. This could make (7'r)-(+)-lyoniresinol 9'-glucoside a potential biomarker for the consumption of these foods. Based on a literature review very few articles have been published on (7'R)-(+)-Lyoniresinol 9'-glucoside.
Structure
Data?1563863281
Synonyms
ValueSource
(+)-Lyoniresinol 3alpha-O-beta-glucopyranosideHMDB
Chemical FormulaC28H38O13
Average Molecular Weight582.5935
Monoisotopic Molecular Weight582.231241302
IUPAC Name2-{[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Traditional Name2-{[7-hydroxy-1-(4-hydroxy-3,5-dimethoxyphenyl)-3-(hydroxymethyl)-6,8-dimethoxy-1,2,3,4-tetrahydronaphthalen-2-yl]methoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
CAS Registry Number87585-32-8
SMILES
COC1=CC2=C(C(C(COC3OC(CO)C(O)C(O)C3O)C(CO)C2)C2=CC(OC)=C(O)C(OC)=C2)C(OC)=C1O
InChI Identifier
InChI=1S/C28H38O13/c1-36-16-7-13(8-17(37-2)22(16)31)20-15(11-40-28-26(35)25(34)23(32)19(10-30)41-28)14(9-29)5-12-6-18(38-3)24(33)27(39-4)21(12)20/h6-8,14-15,19-20,23,25-26,28-35H,5,9-11H2,1-4H3
InChI KeyPQQRNPDHSJDAGV-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as lignan glycosides. These are aromatic polycyclic compounds containing a carbohydrate component glycosidically linked to a lignan moiety. They include 1-aryltetralin lactones.
KingdomOrganic compounds
Super ClassLignans, neolignans and related compounds
ClassLignan glycosides
Sub ClassNot Available
Direct ParentLignan glycosides
Alternative Parents
Substituents
  • Lignan glycoside
  • 1-aryltetralin lignan
  • Hexose monosaccharide
  • Glycosyl compound
  • O-glycosyl compound
  • Methoxyphenol
  • M-dimethoxybenzene
  • Dimethoxybenzene
  • Tetralin
  • Anisole
  • Phenoxy compound
  • Methoxybenzene
  • Phenol ether
  • Phenol
  • Alkyl aryl ether
  • Oxane
  • Benzenoid
  • Monosaccharide
  • Monocyclic benzene moiety
  • Secondary alcohol
  • Polyol
  • Acetal
  • Oxacycle
  • Organoheterocyclic compound
  • Ether
  • Organooxygen compound
  • Alcohol
  • Primary alcohol
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Aromatic heteropolycyclic compound
Molecular FrameworkAromatic heteropolycyclic compounds
External DescriptorsNot Available
Ontology
Physiological effectNot Available
Disposition
ProcessNot Available
RoleNot Available
Physical Properties
StateSolid
Experimental Molecular Properties
PropertyValueReference
Melting Point178 - 180 °CNot Available
Boiling PointNot AvailableNot Available
Water SolubilityNot AvailableNot Available
LogPNot AvailableNot Available
Experimental Chromatographic PropertiesNot Available
Predicted Molecular Properties
PropertyValueSource
Water Solubility0.46 g/LALOGPS
logP0.22ALOGPS
logP-0.31ChemAxon
logS-3.1ALOGPS
pKa (Strongest Acidic)9.24ChemAxon
pKa (Strongest Basic)-2.6ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count13ChemAxon
Hydrogen Donor Count7ChemAxon
Polar Surface Area196.99 ŲChemAxon
Rotatable Bond Count10ChemAxon
Refractivity143.21 m³·mol⁻¹ChemAxon
Polarizability59.58 ųChemAxon
Number of Rings4ChemAxon
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]+231.75831661259
DarkChem[M-H]-225.25931661259
DeepCCS[M+H]+229.07530932474
DeepCCS[M-H]-226.6830932474
DeepCCS[M-2H]-259.56430932474
DeepCCS[M+Na]+234.98830932474
AllCCS[M+H]+231.232859911
AllCCS[M+H-H2O]+229.932859911
AllCCS[M+NH4]+232.432859911
AllCCS[M+Na]+232.832859911
AllCCS[M-H]-226.832859911
AllCCS[M+Na-2H]-229.232859911
AllCCS[M+HCOO]-231.932859911

Predicted Kovats Retention Indices

Underivatized

MetaboliteSMILESKovats RI ValueColumn TypeReference
(7'R)-(+)-Lyoniresinol 9'-glucosideCOC1=CC2=C(C(C(COC3OC(CO)C(O)C(O)C3O)C(CO)C2)C2=CC(OC)=C(O)C(OC)=C2)C(OC)=C1O5042.3Standard polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucosideCOC1=CC2=C(C(C(COC3OC(CO)C(O)C(O)C3O)C(CO)C2)C2=CC(OC)=C(O)C(OC)=C2)C(OC)=C1O4635.6Standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucosideCOC1=CC2=C(C(C(COC3OC(CO)C(O)C(O)C3O)C(CO)C2)C2=CC(OC)=C(O)C(OC)=C2)C(OC)=C1O4941.2Semi standard non polar33892256

Derivatized

Derivative Name / StructureSMILESKovats RI ValueColumn TypeReference
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #1COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O4752.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #2COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4734.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #3COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4704.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #4COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4724.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #5COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O4738.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #6COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O)C(CO)C24763.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,isomer #7COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O4736.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #1COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O4551.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #10COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4528.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #11COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(CO)C24578.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #12COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4501.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #13COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4482.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #14COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4540.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #15COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(CO)C24528.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #16COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4530.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #17COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4509.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #18COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(CO)C24554.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #19COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O4525.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #2COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O4531.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #20COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O)C(CO[Si](C)(C)C)C24543.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #21COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4572.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #3COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4578.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #4COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4535.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #5COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4566.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #6COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O)C1O)C(CO)C24571.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #7COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4556.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #8COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4526.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TMS,isomer #9COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4526.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #1COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O4377.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #10COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4446.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #11COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4520.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #12COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)C(CO)C24465.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #13COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4459.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #14COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)C(CO)C24408.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #15COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)C(CO)C24450.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #16COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4378.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #17COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4383.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #18COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4404.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #19COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4416.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #2COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4435.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #20COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4355.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #21COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4382.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #22COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O)C(CO[Si](C)(C)C)C24393.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #23COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4449.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #24COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(CO)C24408.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #25COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(CO)C24431.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #26COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4324.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #27COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4398.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #28COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O[Si](C)(C)C4350.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #29COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4369.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #3COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4377.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #30COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O)C(CO[Si](C)(C)C)C24346.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #31COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(CO)C24424.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #32COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4343.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #33COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O[Si](C)(C)C4385.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #34COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C)C(CO[Si](C)(C)C)C24361.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #35COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4369.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #4COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4422.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #5COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4404.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #6COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4424.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #7COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4369.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #8COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4410.0Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,3TMS,isomer #9COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O)C1O)C(CO[Si](C)(C)C)C24399.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #1COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O4291.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #10COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O[Si](C)(C)C4295.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #11COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4305.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #12COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4371.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #13COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O)C(CO[Si](C)(C)C)C24307.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #14COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4312.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #15COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O)C(CO[Si](C)(C)C)C24254.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #16COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O)C1O[Si](C)(C)C)C(CO[Si](C)(C)C)C24288.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #17COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4444.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #18COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(CO)C24342.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #19COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(CO)C24430.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #2COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4232.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #20COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(CO)C24355.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #21COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4232.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #22COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4260.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #23COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4259.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #24COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4301.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #25COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O[Si](C)(C)C4261.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #26COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O[Si](C)(C)C4289.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #27COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4280.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #28COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O)C(CO[Si](C)(C)C)C24251.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #29COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O)C1O[Si](C)(C)C)C(CO[Si](C)(C)C)C24277.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #3COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4272.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #30COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(CO)C24330.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #31COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4241.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #32COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O[Si](C)(C)C4210.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #33COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O[Si](C)(C)C4274.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #34COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O[Si](C)(C)C)C1O[Si](C)(C)C)C(CO[Si](C)(C)C)C24259.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #35COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O[Si](C)(C)C4227.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #4COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C)C2COC2OC(CO[Si](C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4247.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #5COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O4314.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #6COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O[Si](C)(C)C)=CC(OC)=C1O4394.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #7COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O[Si](C)(C)C)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C4310.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #8COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O[Si](C)(C)C)=CC(OC)=C1O4326.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,4TMS,isomer #9COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C)C(O)C(O[Si](C)(C)C)C2O)=CC(OC)=C1O[Si](C)(C)C4252.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #1COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O4984.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #2COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(OC)=C1O5002.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #3COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(OC)=C1O4965.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #4COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O4982.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #5COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O4976.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #6COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O)C(CO)C25002.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,1TBDMS,isomer #7COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O4970.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #1COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O5033.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #10COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O5014.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #11COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C1O)C(CO)C25073.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #12COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(OC)=C1O4978.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #13COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(OC)=C1O4984.1Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #14COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O5028.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #15COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O[Si](C)(C)C(C)(C)C)C1O)C(CO)C25018.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #16COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O5010.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #17COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O4993.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #18COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O[Si](C)(C)C(C)(C)C)C(CO)C25047.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #19COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O5027.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #2COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O)=CC(OC)=C1O5035.6Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #20COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO)C(O)C(O)C1O)C(CO[Si](C)(C)C(C)(C)C)C25054.8Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #21COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O)C(O)C2O)=CC(OC)=C1O[Si](C)(C)C(C)(C)C5070.5Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #3COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(OC)=C1O5065.4Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #4COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(OC)=C1O5027.2Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #5COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C2O[Si](C)(C)C(C)(C)C)=CC(OC)=C1O5044.7Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #6COC1=CC2=C(C(OC)=C1O)C(C1=CC(OC)=C(O[Si](C)(C)C(C)(C)C)C(OC)=C1)C(COC1OC(CO[Si](C)(C)C(C)(C)C)C(O)C(O)C1O)C(CO)C25071.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #7COC1=CC(C2C3=C(OC)C(O[Si](C)(C)C(C)(C)C)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(OC)=C1O5038.3Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #8COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO[Si](C)(C)C(C)(C)C)C2COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O)C2O)=CC(OC)=C1O5027.9Semi standard non polar33892256
(7'R)-(+)-Lyoniresinol 9'-glucoside,2TBDMS,isomer #9COC1=CC(C2C3=C(OC)C(O)=C(OC)C=C3CC(CO)C2COC2OC(CO)C(O[Si](C)(C)C(C)(C)C)C(O[Si](C)(C)C(C)(C)C)C2O)=CC(OC)=C1O5008.9Semi standard non polar33892256
Spectra

GC-MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (Non-derivatized) - 70eV, Positivesplash10-0mbi-7401290000-a38971499bd373f3976f2017-09-01Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (1 TMS) - 70eV, Positivesplash10-000i-5622119000-cf99c45d82f8ac4b725c2017-10-06Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS ("(7'R)-(+)-Lyoniresinol 9'-glucoside,1TMS,#1" TMS) - 70eV, PositiveNot Available2021-10-14Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_1_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_1) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_2) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_3) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_4) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_5) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_6) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_7) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_8) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_9) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_10) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_11) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_12) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_13) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_14) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_15) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum
Predicted GC-MSPredicted GC-MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside GC-MS (TMS_2_16) - 70eV, PositiveNot Available2021-10-15Wishart LabView Spectrum

MS/MS Spectra

Spectrum TypeDescriptionSplash KeyDeposition DateSourceView
Experimental LC-MS/MSLC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside , negative-QTOFsplash10-001i-0212390000-17d9c13eab3b0a7928df2017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside , positive-QTOFsplash10-00kb-1693100000-ba8e0c6196daff5db4f42017-09-14HMDB team, MONAView Spectrum
Experimental LC-MS/MSLC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside , positive-QTOFsplash10-0002-0290000000-9d730c25faf7b913dfa22017-09-14HMDB team, MONAView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 10V, Positive-QTOFsplash10-0gc0-0102490000-b51f1920613866be2b472016-08-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 20V, Positive-QTOFsplash10-0udi-0304950000-504da1584c5eacfda0ec2016-08-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 40V, Positive-QTOFsplash10-0udi-5217790000-ab9616b787a593d2a7a42016-08-01Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 10V, Negative-QTOFsplash10-01q9-1200390000-2ecc97af07a0b4337b092016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 20V, Negative-QTOFsplash10-03di-3501390000-5f341a10bd7c2bdf07b52016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 40V, Negative-QTOFsplash10-052g-9102520000-71b9a231309f935698d42016-08-03Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 10V, Negative-QTOFsplash10-001i-0000190000-40a33023a554fdbe57342021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 20V, Negative-QTOFsplash10-0ktu-3003790000-6f21cef938b9b50b2c362021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 40V, Negative-QTOFsplash10-0fe0-3009350000-336161d95630140930702021-09-22Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 10V, Positive-QTOFsplash10-0fer-0116940000-42a0e2d93480e1f3f4312021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 20V, Positive-QTOFsplash10-0f79-0039300000-df0790aaf256e880ed9d2021-09-23Wishart LabView Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - (7'R)-(+)-Lyoniresinol 9'-glucoside 40V, Positive-QTOFsplash10-0gwb-1093640000-293992b73051281e05eb2021-09-23Wishart LabView Spectrum

NMR Spectra

Spectrum TypeDescriptionDeposition DateSourceView
Predicted 1D NMR13C NMR Spectrum (1D, 100 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H NMR Spectrum (1D, 100 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, 1000 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, 200 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, 300 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, 400 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, 500 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, 600 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, 700 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, 800 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR13C NMR Spectrum (1D, 900 MHz, D2O, predicted)2021-09-24Wishart LabView Spectrum
Predicted 1D NMR1H 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 IDFDB021035
KNApSAcK IDC00036313
Chemspider ID23550800
KEGG Compound IDNot Available
BioCyc IDNot Available
BiGG IDNot Available
Wikipedia LinkNot Available
METLIN IDNot Available
PubChem Compound14521083
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.. .