EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:192633 - 4-methoxy-9-(2-methylbut-3-en-2-yl)-7H-furo[3,2-g]chromen-7-one

ChEBI IDCHEBI:192633
ChEBI Name4-methoxy-9-(2-methylbut-3-en-2-yl)-7H-furo[3,2-g]chromen-7-one
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16O4
Net Charge0
Average Mass284.311
Monoisotopic Mass284.10486
SMILESC=CC(C)(C)c1c2occc2c(OC)c2ccc(=O)oc12
InChIInChI=1S/C17H16O4/c1-5-17(2,3)13-15-11(8-9-20-15)14(19-4)10-6-7-12(18)21-16(10)13/h5-9H,1H2,2-4H3
InChIKeyZPLVEUIOSKJIDT-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Valsa sordida (ncbitaxon:252740) Whole Organism (NCIT:C13413) MetaboLights (MTBLS4463)
ChEBI Ontology
Outgoing Relation(s)
4-methoxy-9-(2-methylbut-3-en-2-yl)-7H-furo[3,2-g]chromen-7-one (CHEBI:192633) is a psoralens (CHEBI:26369)
IUPAC Name 
4-methoxy-9-(2-methylbut-3-en-2-yl)uro[3,2-g]chromen-7-one
Manual XrefsDatabases
156162ChemSpider
Registry NumbersSources
CAS:23531-95-5ChemIDplus