EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:185738 - 8-Hydroxy-5,7,3',4'-tetramethoxy-4-phenylcoumarin

ChEBI IDCHEBI:185738
ChEBI Name8-Hydroxy-5,7,3',4'-tetramethoxy-4-phenylcoumarin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC19H18O7
Net Charge0
Average Mass358.346
Monoisotopic Mass358.10525
SMILESCOc1ccc(-c2cc(=O)oc3c(O)c(OC)cc(OC)c23)cc1OC
InChIInChI=1S/C19H18O7/c1-22-12-6-5-10(7-13(12)23-2)11-8-16(20)26-19-17(11)14(24-3)9-15(25-4)18(19)21/h5-9,21H,1-4H3
InChIKeyNESSWJRYPSQBRF-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) feces (BTO:0000440) MetaboLights (MTBLS3750) Strain: C57BL/6 Mouse [NCIT:C14424]
ChEBI Ontology
Outgoing Relation(s)
8-Hydroxy-5,7,3',4'-tetramethoxy-4-phenylcoumarin (CHEBI:185738) is a neoflavonoid (CHEBI:71971)
IUPAC Name 
4-(3,4-dimethoxyphenyl)-8-hydroxy-5,7-dimethoxychromen-2-one
Manual XrefsDatabases
24843142ChemSpider
LMPK12100055LIPID MAPS