5-Chloro-6,8-dihydroxy-1-methoxy-3-methyanthraquinone (CHEBI:202993)

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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	5-Chloro-6,8-dihydroxy-1-methoxy-3-methyanthraquinone

ChEBI ID	CHEBI:202993

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

Submitter	MetaboLights

Supplier Information

Download	Molfile XML SDF

Formula

C16H11ClO5

Net Charge

Average Mass

318.710

Monoisotopic Mass

318.02950

InChI

InChI=1S/C16H11ClO5/c1-6-3-7-11(10(4-6)22-2)16(21)12-8(18)5-9(19)14(17)13(12)15(7)20/h3-5,18-19H,1-2H3

InChIKey

WBJKPIHXBXZBEE-UHFFFAOYSA-N

SMILES

ClC1=C2C(=O)C3=C(C(OC)=CC(=C3)C)C(C2=C(O)C=C1O)=O

Metabolite of Species	Details
Neobulgaria koningiana (NCBI:txid91931)	See: DOI

ChEBI Ontology
Outgoing	5-Chloro-6,8-dihydroxy-1-methoxy-3-methyanthraquinone (CHEBI:202993) is a hydroxyanthraquinones (CHEBI:37485)

IUPAC Name

1-chloro-2,4-dihydroxy-5-methoxy-7-methylanthracene-9,10-dione