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CHEBI:188161 - Herbacetin 7,4'-dimethyl ether 8-acetate

ChEBI IDCHEBI:188161
ChEBI NameHerbacetin 7,4'-dimethyl ether 8-acetate
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H16O8
Net Charge0
Average Mass372.329
Monoisotopic Mass372.08452
SMILESCOc1ccc(-c2oc3c(OC(C)=O)c(OC)cc(O)c3c(=O)c2O)cc1
InChIInChI=1S/C19H16O8/c1-9(20)26-18-13(25-3)8-12(21)14-15(22)16(23)17(27-19(14)18)10-4-6-11(24-2)7-5-10/h4-8,21,23H,1-3H3
InChIKeyJMOATYWEVOXWOP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) blood plasma (BTO:0000131) MetaboLights (MTBLS2224)
ChEBI Ontology
Outgoing Relation(s)
Herbacetin 7,4'-dimethyl ether 8-acetate (CHEBI:188161) is a hydroxyflavan (CHEBI:72010)
IUPAC Name 
[3,5-dihydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxochromen-8-yl] acetate
Manual XrefsDatabases
LMPK12113169LIPID MAPS
24845702ChemSpider