5-O-methylcelebixanthone (CHEBI:65607)

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ChEBI Name	5-O-methylcelebixanthone

ChEBI ID	CHEBI:65607

ChEBI ASCII Name	5-O-methylcelebixanthone

Definition	A member of the class of xanthones that is 9H-xanthen-9-one substituted by hydroxy groups at positions 3 and 8, methoxy groups at position 2 and 4 and a prenyl group at position 1. A methyl ether derivative of celebixanthone, it is isolated from the roots of Cratoxylum cochinchinense and exhibits antimalarial activities.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C20H20O6

Net Charge

Average Mass

356.36920

Monoisotopic Mass

356.12599

InChI

InChI=1S/C20H20O6/c1-10(2)8-9-11-14-16(22)15-12(21)6-5-7-13(15)26-19(14)20(25-4)17(23)18(11)24-3/h5-8,21,23H,9H2,1-4H3

InChIKey

AIBPYVNEBSHOCZ-UHFFFAOYSA-N

SMILES

COc1c(O)c(OC)c2oc3cccc(O)c3c(=O)c2c1CC=C(C)C

Metabolite of Species	Details
Cratoxylum cochinchinense (NCBI:txid271749)	Found in root (BTO:0001188). See: PubMed

Roles Classification
Biological Role(s):	antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Application(s):	antimalarial A drug used in the treatment of malaria. Antimalarials are usually classified on the basis of their action against Plasmodia at different stages in their life cycle in the human.

ChEBI Ontology
Outgoing	5-O-methylcelebixanthone (CHEBI:65607) has functional parent celebixanthone (CHEBI:65606) 5-O-methylcelebixanthone (CHEBI:65607) has role antimalarial (CHEBI:38068) 5-O-methylcelebixanthone (CHEBI:65607) has role metabolite (CHEBI:25212) 5-O-methylcelebixanthone (CHEBI:65607) is a aromatic ether (CHEBI:35618) 5-O-methylcelebixanthone (CHEBI:65607) is a polyphenol (CHEBI:26195) 5-O-methylcelebixanthone (CHEBI:65607) is a xanthones (CHEBI:51149)

IUPAC Name

3,8-dihydroxy-2,4-dimethoxy-1-(3-methylbut-2-en-1-yl)-9H-xanthen-9-one

Registry Number	Type	Source
10380107	Reaxys Registry Number	Reaxys

Citation	Type	Source
16651783	PubMed citation	Europe PMC

Last Modified

10 December 2012