2'-acetoxy-7-chlorocitreorosein (CHEBI:226308)

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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	2'-acetoxy-7-chlorocitreorosein

ChEBI ID	CHEBI:226308

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C18H13ClO7

Net Charge

Average Mass

376.750

Monoisotopic Mass

376.03498

InChI

InChI=1S/C18H13ClO7/c1-7(20)26-6-8-3-9-13(11(21)4-8)17(24)14-10(16(9)23)5-12(22)15(19)18(14)25-2/h3-5,21-22H,6H2,1-2H3

InChIKey

OWTNKMFURYLDCW-UHFFFAOYSA-N

SMILES

ClC1=C(OC)C=2C(=O)C3=C(O)C=C(COC(=O)C)C=C3C(C2C=C1O)=O

Metabolite of Species	Details
Penicillium (NCBI:txid5073)	See: PubMed

ChEBI Ontology
Outgoing	2'-acetoxy-7-chlorocitreorosein (CHEBI:226308) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name

(6-chloro-4,7-dihydroxy-5-methoxy-9,10-dioxoanthracen-2-yl)methyl acetate