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CHEBI:185412 - 5,7,8-Trihydroxy-4'-methoxyflavanone

ChEBI IDCHEBI:185412
ChEBI Name5,7,8-Trihydroxy-4'-methoxyflavanone
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC16H14O6
Net Charge0
Average Mass302.282
Monoisotopic Mass302.07904
SMILESCOc1ccc([C@@H]2CC(=O)c3c(O)cc(O)c(O)c3O2)cc1
InChIInChI=1S/C16H14O6/c1-21-9-4-2-8(3-5-9)13-7-11(18)14-10(17)6-12(19)15(20)16(14)22-13/h2-6,13,17,19-20H,7H2,1H3/t13-/m0/s1
InChIKeyOVDFVZLTXMMPDE-ZDUSSCGKSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
5,7,8-Trihydroxy-4'-methoxyflavanone (CHEBI:185412) is a ether (CHEBI:25698)
5,7,8-Trihydroxy-4'-methoxyflavanone (CHEBI:185412) is a flavonoids (CHEBI:72544)
IUPAC Name 
(2S)-5,7,8-trihydroxy-2-(4-methoxyphenyl)-2,3-dihydrochromen-4-one
Manual XrefsDatabases
24846628ChemSpider
LMPK12140671LIPID MAPS