9-methoxycanthin-6-one (CHEBI:66699)

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CHEBI:66699 - 9-methoxycanthin-6-one

ChEBI ID	CHEBI:66699
ChEBI Name	9-methoxycanthin-6-one
Stars
Definition	An indole alkaloid that is the 9-methoxy derivative of canthin-6-one. Isolated from Eurycoma longifolia and Simaba multiflora, it exhibits cytotoxic activity towards human cancer cell lines.
Last Modified	7 November 2013
Downloads	Molfile

Formula	C15H10N2O2
Net Charge	0
Average Mass	250.257
Monoisotopic Mass	250.07423
SMILES	COc1ccc2c3ccnc4ccc(=O)n(c2c1)c43
InChI	InChI=1S/C15H10N2O2/c1-19-9-2-3-10-11-6-7-16-12-4-5-14(18)17(15(11)12)13(10)8-9/h2-8H,1H3
InChIKey	OWCRARVHWCCRAG-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Simaba cuspidata (IPNI:236515-2)	bark (BTO:0001301)	DOI (10.1016/S0031-9422(00)81981-0)
Simaba multiflora (IPNI:236532-2)	xylem (BTO:0001468)	DOI (10.1016/S0040-4039(00)86970-1)	Previous component: wood;
Eurycoma longifolia (ncbitaxon:458531)	root (BTO:0001188)	PubMed (1800638)

Roles Classification

Biological Roles:

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

antiplasmodial drug An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

Applications:

antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

antiplasmodial drug An antiparasitic drug which is effective against Apicomplexan parasites in the genus Plasmodium. The genus contains over 200 species and includes those responsible for malaria.

ChEBI Ontology

Outgoing Relation(s)
	9-methoxycanthin-6-one (CHEBI:66699) has functional parent canthin-6-one (CHEBI:3363)
	9-methoxycanthin-6-one (CHEBI:66699) has role antineoplastic agent (CHEBI:35610)
	9-methoxycanthin-6-one (CHEBI:66699) has role antiplasmodial drug (CHEBI:64915)
	9-methoxycanthin-6-one (CHEBI:66699) has role metabolite (CHEBI:25212)
	9-methoxycanthin-6-one (CHEBI:66699) is a aromatic ether (CHEBI:35618)
	9-methoxycanthin-6-one (CHEBI:66699) is a indole alkaloid (CHEBI:38958)
	9-methoxycanthin-6-one (CHEBI:66699) is a organic heterotetracyclic compound (CHEBI:38163)

IUPAC Name
9-methoxy-6H-indolo[3,2,1-de][1,5]naphthyridin-6-one

Synonyms	Source
13-methoxy-1,6-diazatetracyclo[7.6.1.0(5,16).0(10,15)]hexadeca-3,5(16),6,8,10,12,14-heptaen-2-one	ChEBI
8-methoxycanthin-6-one	ChEBI

Registry Numbers	Sources
Reaxys:4470310	Reaxys

Citations