CHEBI:208560 - Peniquinone A

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Peniquinone A
ChEBI ID CHEBI:208560
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H18O6
Net Charge 0
Average Mass 318.325
Monoisotopic Mass 318.11034
InChI InChI=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
InChIKey PAWIDFOBWAGENE-UHFFFAOYSA-N
SMILES O=C1C(OC)=CC(=O)C(=C1C)C2=C(O)C=C(OC)C(=C2C)OC
Metabolite of Species Details
Penicillium (NCBI:txid5073) See: PubMed
ChEBI Ontology
Outgoing 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 Xref Database
75590275 ChemSpider
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