4-Ketoifosfamide (CHEBI:80561)

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ChEBI Name	4-Ketoifosfamide

ChEBI ID	CHEBI:80561

Stars	This entity has been manually annotated by a third party.

Supplier Information

Download	Molfile XML SDF

Formula

C7H13Cl2N2O3P

Net Charge

Average Mass

275.06900

Monoisotopic Mass

274.00408

InChI

InChI=1S/C7H13Cl2N2O3P/c8-2-4-10-15(13)11(5-3-9)7(12)1-6-14-15/h1-6H2,(H,10,13)

InChIKey

PEZLCTIXHCOEOG-UHFFFAOYSA-N

SMILES

ClCCNP1(=O)OCCC(=O)N1CCCl

Roles Classification
Biological Role(s):	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. (via nitrogen mustard )

ChEBI Ontology
Outgoing	4-Ketoifosfamide (CHEBI:80561) is a ifosfamides (CHEBI:55369)

Registry Number	Type	Source
42436-20-4	CAS Registry Number	KEGG COMPOUND