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CHEBI:177836 - (E)-dacarbazine

ChEBI IDCHEBI:177836
ChEBI Name(E)-dacarbazine
Stars
ASCII Name(E)-dacarbazine
DefinitionA dacarbazine in which the N=N double bond adopts a trans-configuration.
Last Modified4 November 2021
SubmitterMetaboLights
DownloadsMolfile
FormulaC6H10N6O
Net Charge0
Average Mass182.187
Monoisotopic Mass182.09161
SMILESCN(C)/N=N/c1ncnc1C(N)=O
InChIInChI=1S/C6H10N6O/c1-12(2)11-10-6-4(5(7)13)8-3-9-6/h3H,1-2H3,(H2,7,13)(H,8,9)/b11-10+
InChIKeyFDKXTQMXEQVLRF-ZHACJKMWSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Biological Roles:
carcinogenic agent  A role played by a chemical compound which is known to induce a process of carcinogenesis by corrupting normal cellular pathways, leading to the acquistion of tumoral capabilities.
alkylating agent  Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases.
Applications:
prodrug  A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
(E)-dacarbazine (CHEBI:177836) is a dacarbazine (CHEBI:4305)
IUPAC Name 
5-[(1E)-3,3-dimethyltriaz-1-en-1-yl]-1H-imidazole-4-carboxamide
Synonym  Source
trans-dacarbazineChEBI
Manual XrefsDatabases
10481959ChemSpider