CHEBI:81487 - Isobergapten

ChEBI IDCHEBI:81487
ChEBI NameIsobergapten
Stars
Last Modified25 February 2016
DownloadsMolfile
FormulaC12H8O4
Net Charge0
Average Mass216.192
Monoisotopic Mass216.04226
SMILESCOc1cc2occc2c2oc(=O)ccc12
InChIInChI=1S/C12H8O4/c1-14-9-6-10-8(4-5-15-10)12-7(9)2-3-11(13)16-12/h2-6H,1H3
InChIKeyAJSPSRWWZBBIOR-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Isobergapten (CHEBI:81487) is a furanocoumarin (CHEBI:24128)
Manual XrefsDatabases
C18082KEGG COMPOUND
LSM-20952LINCS
Registry NumbersSources
CAS:482-48-4KEGG COMPOUND