(+/-)-sclerotiorumin A (CHEBI:206152)

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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	(+/-)-sclerotiorumin A

ChEBI ID	CHEBI:206152

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C14H14O5

Net Charge

Average Mass

262.261

Monoisotopic Mass

262.08412

InChI

InChI=1S/C14H14O5/c1-7-6-19-14(3,13(7)17)11-8(2)12(16)10(18-4)5-9(11)15/h5-6H,1-4H3/t14-/m1/s1

InChIKey

QTXFUTOATGTAAH-CQSZACIVSA-N

SMILES

O=C1C(OC)=CC(=O)C(=C1C)[C@]2(OC=C(C2=O)C)C

Metabolite of Species	Details
Aspergillus (NCBI:txid5052)	See: PubMed

ChEBI Ontology
Outgoing	(+/-)-sclerotiorumin A (CHEBI:206152) is a prenylquinone (CHEBI:26255)

IUPAC Name

2-(2,4-dimethyl-3-oxouran-2-yl)-5-methoxy-3-methylcyclohexa-2,5-diene-1,4-dione