chelerythrine (CHEBI:78373)

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ChEBI Name	chelerythrine

ChEBI ID	CHEBI:78373

Definition	A benzophenanthridine alkaloid isolated from the root of Zanthoxylum simulans, Chelidonium majus L., and other Papaveraceae.

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

Submitter	KAX

Secondary ChEBI IDs	CHEBI:31388

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Formula

C21H18NO4

Net Charge

Average Mass

348.37140

Monoisotopic Mass

348.12303

InChI

InChI=1S/C21H18NO4/c1-22-10-16-13(6-7-17(23-2)21(16)24-3)14-5-4-12-8-18-19(26-11-25-18)9-15(12)20(14)22/h4-10H,11H2,1-3H3/q+1

InChIKey

LLEJIEBFSOEYIV-UHFFFAOYSA-N

SMILES

COc1ccc2c(c[n+](C)c3c4cc5OCOc5cc4ccc23)c1OC

Roles Classification
Biological Role(s):	EC 2.7.11.13 (protein kinase C) inhibitor An EC 2.7.11.* (protein-serine/threonine kinase) inhibitor that interferes with the action of protein kinase C (EC 2.7.11.13). antibacterial agent A substance (or active part thereof) that kills or slows the growth of bacteria. metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. (via alkaloid )

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	chelerythrine (CHEBI:78373) has role antibacterial agent (CHEBI:33282) chelerythrine (CHEBI:78373) has role antineoplastic agent (CHEBI:35610) chelerythrine (CHEBI:78373) has role EC 2.7.11.13 (protein kinase C) inhibitor (CHEBI:37700) chelerythrine (CHEBI:78373) is a benzophenanthridine alkaloid (CHEBI:38517) chelerythrine (CHEBI:78373) is a organic cation (CHEBI:25697)

IUPAC Name

1,2-dimethoxy-12-methyl[1,3]benzodioxolo[5,6-c]phenanthridin-12-ium

Synonyms	Sources
1,2-Dimethoxy-12-methyl(1,3)benzodioxolo(5,6-c)phenanthridinium	ChemIDplus
chelerythrine	UniProt

Last Modified

24 February 2016