1,5-dihydroxy-3-(2-oxopropyl)-6-methoxycarbonylxanthone (CHEBI:203066)

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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	1,5-dihydroxy-3-(2-oxopropyl)-6-methoxycarbonylxanthone

ChEBI ID	CHEBI:203066

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H14O7

Net Charge

Average Mass

342.303

Monoisotopic Mass

342.07395

InChI

InChI=1S/C18H14O7/c1-8(19)5-9-6-12(20)14-13(7-9)25-17-10(15(14)21)3-4-11(16(17)22)18(23)24-2/h3-4,6-7,20,22H,5H2,1-2H3

InChIKey

KIJTTYRRBNSKMV-UHFFFAOYSA-N

SMILES

O=C1C2=C(OC3=C1C=CC(=C3O)C(=O)OC)C=C(CC(=O)C)C=C2O

Metabolite of Species	Details
Diaporthe amygdali (NCBI:txid1214568)	See: DOI

ChEBI Ontology
Outgoing	1,5-dihydroxy-3-(2-oxopropyl)-6-methoxycarbonylxanthone (CHEBI:203066) is a xanthones (CHEBI:51149)

IUPAC Name

methyl 4,8-dihydroxy-9-oxo-6-(2-oxopropyl)xanthene-3-carboxylate