Penicidone C (CHEBI:217148)

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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	Penicidone C

ChEBI ID	CHEBI:217148

Stars	This entity has been manually annotated by a third party.

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C19H19NO6

Net Charge

Average Mass

357.362

Monoisotopic Mass

357.12124

InChI

InChI=1S/C19H19NO6/c1-5-6-11-7-15(21)14(10-20-11)18(22)17-13(19(23)26-4)8-12(24-2)9-16(17)25-3/h5-10H,1-4H3,(H,20,21)/b6-5+

InChIKey

VPAOKPNCSUMTKK-AATRIKPKSA-N

SMILES

O=C1C(C(=O)C2=C(OC)C=C(OC)C=C2C(=O)OC)=CNC(=C1)/C=C/C

Metabolite of Species	Details
Penicilliumspecies IFB-E022 (NCBI:txid419823)	See: PubMed

ChEBI Ontology
Outgoing	Penicidone C (CHEBI:217148) is a aromatic ketone (CHEBI:76224)

IUPAC Name

methyl 3,5-dimethoxy-2-[4-oxo-6-[(E)-prop-1-enyl]-1H-pyridine-3-carbonyl]benzoate