cystodytin G (CHEBI:65713)

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ChEBI Name	cystodytin G

ChEBI ID	CHEBI:65713

Definition	An alkaloid that is an enamide obtained by the formal condensation of tiglic acid with 6-(2-amino-1-methoxyethyl)-4H-pyrido[2,3,4-kl]acridin-4-one. It is isolated from the Okinawan marine tunicate Cystodytes dellechiajei and exhibits cytotoxicity against human epidermoid carcinoma KB cells

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

Supplier Information

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Formula

C23H21N3O3

Net Charge

Average Mass

387.43110

Monoisotopic Mass

387.15829

InChI

InChI=1S/C23H21N3O3/c1-4-13(2)23(28)25-12-19(29-3)16-11-18(27)22-20-15(9-10-24-22)14-7-5-6-8-17(14)26-21(16)20/h4-11,19H,12H2,1-3H3,(H,25,28)/b13-4+

InChIKey

JVXRZQHXFSTRRG-YIXHJXPBSA-N

SMILES

COC(CNC(=O)C(\C)=C\C)C1=CC(=O)c2nccc3c4ccccc4nc1c23

Metabolite of Species	Details
Cystodytes dellechiajei (NCBI:txid260824)	See: PubMed

Roles Classification
Biological Role(s):	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	cystodytin G (CHEBI:65713) has functional parent tiglic acid (CHEBI:9592) cystodytin G (CHEBI:65713) has role antineoplastic agent (CHEBI:35610) cystodytin G (CHEBI:65713) has role metabolite (CHEBI:25212) cystodytin G (CHEBI:65713) is a alkaloid (CHEBI:22315) cystodytin G (CHEBI:65713) is a enamide (CHEBI:51751) cystodytin G (CHEBI:65713) is a enone (CHEBI:51689) cystodytin G (CHEBI:65713) is a ether (CHEBI:25698) cystodytin G (CHEBI:65713) is a organic heterotetracyclic compound (CHEBI:38163) cystodytin G (CHEBI:65713) is a secondary carboxamide (CHEBI:140325)

IUPAC Name

(2E)-N-[2-methoxy-2-(4-oxo-4H-pyrido[2,3,4-kl]acridin-6-yl)ethyl]-2-methylbut-2-enamide

Citation	Type	Source
1812214	PubMed citation	Europe PMC

Last Modified

07 March 2018