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CHEBI:82452 - 4,4'-Dimethylangelicin

ChEBI IDCHEBI:82452
ChEBI Name4,4'-Dimethylangelicin
Stars
DownloadsMolfile
FormulaC13H10O3
Net Charge0
Average Mass214.220
Monoisotopic Mass214.06299
SMILESCc1cc(=O)oc2c1ccc1occ(C)c12
InChIInChI=1S/C13H10O3/c1-7-5-11(14)16-13-9(7)3-4-10-12(13)8(2)6-15-10/h3-6H,1-2H3
InChIKeyZUOUYRRXKPHFSV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4,4'-Dimethylangelicin (CHEBI:82452) is a furanocoumarin (CHEBI:24128)
Manual XrefsDatabases
C19404KEGG COMPOUND
Registry NumbersSources
CAS:22975-76-4KEGG COMPOUND