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CHEBI:221065 - Citreopyrone A

ChEBI IDCHEBI:221065
ChEBI NameCitreopyrone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC12H12O4
Net Charge0
Average Mass220.224
Monoisotopic Mass220.07356
SMILESCOc1cc(=O)oc(/C=C/C=C/C=O)c1C
InChIInChI=1S/C12H12O4/c1-9-10(6-4-3-5-7-13)16-12(14)8-11(9)15-2/h3-8H,1-2H3/b5-3+,6-4+
InChIKeyMLFGJPIHJMFFLG-GGWOSOGESA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - DOI (10.1246/cl.1997.33)
ChEBI Ontology
Outgoing Relation(s)
Citreopyrone A (CHEBI:221065) is a pyranone (CHEBI:37963)
IUPAC Name 
(2E,4E)-5-(4-methoxy-3-methyl-6-oxopyran-2-yl)penta-2,4-dienal
Manual XrefsDatabases
8926713ChemSpider