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CHEBI:228984 - 2'-Acetylangelicin

ChEBI IDCHEBI:228984
ChEBI Name2'-Acetylangelicin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC13H8O4
Net Charge0
Average Mass228.203
Monoisotopic Mass228.04226
SMILESCC(=O)c1cc2c(ccc3ccc(=O)oc32)o1
InChIInChI=1S/C13H8O4/c1-7(14)11-6-9-10(16-11)4-2-8-3-5-12(15)17-13(8)9/h2-6H,1H3
InChIKeyFHBLDHGQJXHHPA-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Zea mays (ncbitaxon:4577) exometabolome MetaboLights (MTBLS8903)
ChEBI Ontology
Outgoing Relation(s)
2'-Acetylangelicin (CHEBI:228984) is a furanocoumarin (CHEBI:24128)
IUPAC Name 
8-acetyluro[2,3-h]chromen-2-one
Manual XrefsDatabases
4474785ChemSpider