EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:193257 - Methyldalbergin

ChEBI IDCHEBI:193257
ChEBI NameMethyldalbergin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14O4
Net Charge0
Average Mass282.295
Monoisotopic Mass282.08921
SMILESCOc1cc2oc(=O)cc(-c3ccccc3)c2cc1OC
InChIInChI=1S/C17H14O4/c1-19-15-8-13-12(11-6-4-3-5-7-11)9-17(18)21-14(13)10-16(15)20-2/h3-10H,1-2H3
InChIKeyBUZZVHCRHOIKOC-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) feces (BTO:0000440) MetaboLights (MTBLS5335)
ChEBI Ontology
Outgoing Relation(s)
Methyldalbergin (CHEBI:193257) is a neoflavonoid (CHEBI:71971)
IUPAC Name 
6,7-dimethoxy-4-phenylchromen-2-one
Manual XrefsDatabases
1038080ChemSpider
LMPK12100006LIPID MAPS