Viticolin A (CHEBI:210103)

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	Viticolin A

ChEBI ID	CHEBI:210103

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

Submitter	MetaboLights

Supplier Information	ChemicalBook:CB5855401, ZINC000005854633

Download	Molfile XML SDF

Formula

C9H8O6

Net Charge

Average Mass

212.157

Monoisotopic Mass

212.03209

InChI

InChI=1S/C9H8O6/c1-15-8-6(11)3-4(9(13)14)2-5(10)7(8)12/h2-3,10,12H,1H3,(H,13,14)

InChIKey

YBFBDXOODOEQOV-UHFFFAOYSA-N

SMILES

O=C1C(OC)=C(O)C(O)=CC(=C1)C(=O)O

Metabolite of Species	Details
Penicillium viticola (NCBI:txid1071046)	See: PubMed

ChEBI Ontology
Outgoing	Viticolin A (CHEBI:210103) is a cyclic ketone (CHEBI:3992)

IUPAC Name

5,6-dihydroxy-4-methoxy-3-oxocyclohepta-1,4,6-triene-1-carboxylic acid