Paeciloquinone A (CHEBI:216357)

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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	Paeciloquinone A

ChEBI ID	CHEBI:216357

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H12O8

Net Charge

Average Mass

356.286

Monoisotopic Mass

356.05322

InChI

InChI=1S/C18H12O8/c19-6-3-8-13(10(20)4-6)17(24)14-9(15(8)22)5-11(21)12(16(14)23)7-1-2-26-18(7)25/h3-5,7,19-21,23H,1-2H2/t7-/m1/s1

InChIKey

CCJBPPLPVJLTRD-SSDOTTSWSA-N

SMILES

O=C1C2=C(O)C(=C(O)C=C2C(=O)C=3C1=C(O)C=C(O)C3)[C@@H]4C(=O)OCC4

Metabolite of Species	Details
Paecilomyces (NCBI:txid33202)	See: PubMed

ChEBI Ontology
Outgoing	Paeciloquinone A (CHEBI:216357) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name

1,3,6,8-tetrahydroxy-2-(2-oxooxolan-3-yl)anthracene-9,10-dione