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CHEBI:28928 - angelicin

Default Structure
ChEBI IDCHEBI:28928
ChEBI Nameangelicin
Stars
Secondary ChEBI IDsCHEBI:2717, CHEBI:24918
Last Modified28 July 2014
DownloadsMolfile
FormulaC11H6O3
Net Charge0
Average Mass186.166
Monoisotopic Mass186.03169
SMILESO=c1ccc2ccc3occc3c2o1
InChIInChI=1S/C11H6O3/c12-10-4-2-7-1-3-9-8(5-6-13-9)11(7)14-10/h1-6H
InChIKeyXDROKJSWHURZGO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
angelicin (CHEBI:28928) is a furanocoumarin (CHEBI:24128)
IUPAC Name 
2H-furo[2,3-h]chromen-2-one
Synonyms  Source
AngelicinKEGG COMPOUND
IsopsoralenKEGG COMPOUND
UniProt Name  Source
angelicinUniProt
Manual XrefsDatabases
C00002450KNApSAcK
C09060KEGG COMPOUND
Registry NumbersSources
Beilstein:153970Beilstein
CAS:523-50-2KEGG COMPOUND
CAS:523-50-2ChemIDplus