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CHEBI:1887 - 4-Ketocyclophosphamide

ChEBI IDCHEBI:1887
ChEBI Name4-Ketocyclophosphamide
Stars
Last Modified28 July 2014
DownloadsMolfile
FormulaC7H13Cl2N2O3P
Net Charge0
Average Mass275.072
Monoisotopic Mass274.00408
SMILESO=C1CCOP(=O)(N(CCCl)CCCl)N1
InChIInChI=1S/C7H13Cl2N2O3P/c8-2-4-11(5-3-9)15(13)10-7(12)1-6-14-15/h1-6H2,(H,10,12,13)
InChIKeyVBMZHOCORXMDJU-UHFFFAOYSA-N
Roles Classification
Biological Role:
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.
ChEBI Ontology
Outgoing Relation(s)
4-Ketocyclophosphamide (CHEBI:1887) is a nitrogen mustard (CHEBI:37598)
Synonym  Source
4-KetocyclophosphamideKEGG COMPOUND
Manual XrefsDatabases
C07644KEGG COMPOUND
HMDB0060686HMDB
Registry NumbersSources
CAS:27046-19-1KEGG COMPOUND