CHEBI:65710 - cystodytin D

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ChEBI Name cystodytin D
ChEBI ID CHEBI:65710
Definition An alkaloid that is an enamide obtained by the formal condensation of 3-methylbut-2-enoic acid with 6-(2-amino-1-hydroxyethyl)-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 C22H19N3O3
Net Charge 0
Average Mass 373.40460
Monoisotopic Mass 373.14264
InChI InChI=1S/C22H19N3O3/c1-12(2)9-19(28)24-11-18(27)15-10-17(26)22-20-14(7-8-23-22)13-5-3-4-6-16(13)25-21(15)20/h3-10,18,27H,11H2,1-2H3,(H,24,28)
InChIKey ANJZOYDQOAVRCX-UHFFFAOYSA-N
SMILES CC(C)=CC(=O)NCC(O)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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing cystodytin D (CHEBI:65710) has functional parent 3-methylbut-2-enoic acid (CHEBI:37127)
cystodytin D (CHEBI:65710) has role antineoplastic agent (CHEBI:35610)
cystodytin D (CHEBI:65710) has role metabolite (CHEBI:25212)
cystodytin D (CHEBI:65710) is a alkaloid (CHEBI:22315)
cystodytin D (CHEBI:65710) is a enamide (CHEBI:51751)
cystodytin D (CHEBI:65710) is a enone (CHEBI:51689)
cystodytin D (CHEBI:65710) is a organic heterotetracyclic compound (CHEBI:38163)
cystodytin D (CHEBI:65710) is a secondary alcohol (CHEBI:35681)
cystodytin D (CHEBI:65710) is a secondary carboxamide (CHEBI:140325)
Incoming cystodytin H (CHEBI:65714) has functional parent cystodytin D (CHEBI:65710)
IUPAC Name
N-[2-hydroxy-2-(4-oxo-4H-pyrido[2,3,4-kl]acridin-6-yl)ethyl]-3-methylbut-2-enamide
Manual Xref Database
10473433 ChemSpider
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Citation Waiting for Citations Type Source
1812214 PubMed citation Europe PMC
Last Modified
07 March 2018