EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:229865 - odoratin

ChEBI IDCHEBI:229865
ChEBI Nameodoratin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O6
Net Charge0
Average Mass314.293
Monoisotopic Mass314.07904
SMILESCOc1ccc(-c2coc3cc(O)c(OC)cc3c2=O)cc1O
InChIInChI=1S/C17H14O6/c1-21-14-4-3-9(5-12(14)18)11-8-23-15-7-13(19)16(22-2)6-10(15)17(11)20/h3-8,18-19H,1-2H3
InChIKeyBYNYZQQDQIQLSO-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS9087)
ChEBI Ontology
Outgoing Relation(s)
odoratin (CHEBI:229865) is a isoflavonoid (CHEBI:50753)
IUPAC Name 
7-hydroxy-3-(3-hydroxy-4-methoxyphenyl)-6-methoxychromen-4-one
Manual XrefsDatabases
LMPK12050113LIPID MAPS
23326363ChemSpider