EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:224861 - Anserinone A

ChEBI IDCHEBI:224861
ChEBI NameAnserinone A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H12O4
Net Charge0
Average Mass208.213
Monoisotopic Mass208.07356
SMILESCOC1=CC(=O)C(C)=C(CC(C)=O)C1=O
InChIInChI=1S/C11H12O4/c1-6(12)4-8-7(2)9(13)5-10(15-3)11(8)14/h5H,4H2,1-3H3
InChIKeyMIKCTUJVVLWHFM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Podospora anserina (ncbitaxon:2587412) - PubMed (9214737)
ChEBI Ontology
Outgoing Relation(s)
Anserinone A (CHEBI:224861) is a p-quinones (CHEBI:25830)
Anserinone A (CHEBI:224861) is a benzoquinones (CHEBI:22729)
IUPAC Name 
5-methoxy-2-methyl-3-(2-oxopropyl)cyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
154446ChemSpider