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CHEBI:1864 - 4-hydroxycyclophosphamide
| Formula | C7H15Cl2N2O3P |
| Net Charge | 0 |
| Average Mass | 277.088 |
| Monoisotopic Mass | 276.01973 |
| SMILES | O=P1(N(CCCl)CCCl)NC(O)CCO1 |
| InChI | InChI=1S/C7H15Cl2N2O3P/c8-2-4-11(5-3-9)15(13)10-7(12)1-6-14-15/h7,12H,1-6H2,(H,10,13) |
| InChIKey | RANONBLIHMVXAJ-UHFFFAOYSA-N |
| Wikipedia |
|---|
| Roles Classification |
|---|
| Biological Roles: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. 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. 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-hydroxycyclophosphamide (CHEBI:1864) has role alkylating agent (CHEBI:22333) |
| 4-hydroxycyclophosphamide (CHEBI:1864) has role metabolite (CHEBI:25212) |
| 4-hydroxycyclophosphamide (CHEBI:1864) is a nitrogen mustard (CHEBI:37598) |
| 4-hydroxycyclophosphamide (CHEBI:1864) is a organochlorine compound (CHEBI:36683) |
| 4-hydroxycyclophosphamide (CHEBI:1864) is a phosphorodiamide (CHEBI:35467) |
| IUPAC Name |
|---|
| 2-[bis(2-chloroethyl)amino]-1,3,2-oxazaphosphinan-4-ol 2-oxide |
| Synonyms | Source |
|---|---|
| 4-Hydroxycyclophosphamide | KEGG COMPOUND |
| Tetrahydro-2-(bis(2-chloroethyl)amino)-2H-1,3,2-oxazaphosphorin-4-ol 2-oxide | ChemIDplus |
| Manual Xrefs | Databases |
|---|---|
| C07643 | KEGG COMPOUND |
| 4-Hydroxycyclophosphamide | Wikipedia |
| Registry Numbers | Sources |
|---|---|
| Reaxys:526395 | Reaxys |
| CAS:40277-05-2 | KEGG COMPOUND |
| CAS:40277-05-2 | ChemIDplus |