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CHEBI:208560 - Peniquinone A

ChEBI IDCHEBI:208560
ChEBI NamePeniquinone A
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SubmitterMetaboLights
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FormulaC17H18O6
Net Charge0
Average Mass318.325
Monoisotopic Mass318.11034
SMILESCOC1=CC(=O)C(c2c(O)cc(OC)c(OC)c2C)=C(C)C1=O
InChIInChI=1S/C17H18O6/c1-8-14(10(18)6-12(21-3)16(8)20)15-9(2)17(23-5)13(22-4)7-11(15)19/h6-7,19H,1-5H3
InChIKeyPAWIDFOBWAGENE-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Penicillium (ncbitaxon:5073) - PubMed (31248044)
ChEBI Ontology
Outgoing Relation(s)
Peniquinone A (CHEBI:208560) is a methoxybenzenes (CHEBI:51683)
Peniquinone A (CHEBI:208560) is a phenols (CHEBI:33853)
IUPAC Name 
2-(6-hydroxy-3,4-dimethoxy-2-methylphenyl)-5-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione
Manual XrefsDatabases
75590275ChemSpider