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CHEBI:191569 - (7'R)-(+)-Lyoniresinol 9'-glucoside

ChEBI IDCHEBI:191569
ChEBI Name(7'R)-(+)-Lyoniresinol 9'-glucoside
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC28H38O13
Net Charge0
Average Mass582.599
Monoisotopic Mass582.23124
SMILESCOc1cc(C2c3c(cc(OC)c(O)c3OC)CC(CO)C2COC2OC(CO)C(O)C(O)C2O)cc(OC)c1O
InChIInChI=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
InChIKeyPQQRNPDHSJDAGV-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Ulmus parvifolia (ncbitaxon:63058)
bark (BTO:0001301) MetaboLights (MTBLS4572)
seed (BTO:0001226) MetaboLights (MTBLS4572)
Solanum tuberosum (ncbitaxon:4113) leaf (BTO:0000713) MetaboLights (MTBLS4365)
ChEBI Ontology
Outgoing Relation(s)
(7'R)-(+)-Lyoniresinol 9'-glucoside (CHEBI:191569) is a glycoside (CHEBI:24400)
(7'R)-(+)-Lyoniresinol 9'-glucoside (CHEBI:191569) is a lignan (CHEBI:25036)
IUPAC Name 
2-[[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
Manual XrefsDatabases
23550800ChemSpider
HMDB0038922HMDB