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CHEBI:213193 - Asperphenone A

ChEBI IDCHEBI:213193
ChEBI NameAsperphenone A
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SubmitterMetaboLights
DownloadsMolfile
FormulaC17H16O7
Net Charge0
Average Mass332.308
Monoisotopic Mass332.08960
SMILESCOC1=C(O)C(=O)C(C)=C(Cc2c(O)ccc(C(C)=O)c2O)C1=O
InChIInChI=1S/C17H16O7/c1-7-10(15(22)17(24-3)16(23)13(7)20)6-11-12(19)5-4-9(8(2)18)14(11)21/h4-5,19,21,23H,6H2,1-3H3
InChIKeyHNWSKAQTVNQOHM-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Aspergillus (ncbitaxon:5052) - PubMed (29385686)
Roles Classification
Biological Roles:
Escherichia coli metabolite  Any bacterial metabolite produced during a metabolic reaction in Escherichia coli.
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
ChEBI Ontology
Outgoing Relation(s)
Asperphenone A (CHEBI:213193) is a ubiquinones (CHEBI:16389)
IUPAC Name 
2-[(3-acetyl-2,6-dihydroxyphenyl)methyl]-5-hydroxy-6-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
64853485ChemSpider