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CHEBI ONTOLOGY - ANNOTATIONS

The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at http://www.ebi.ac.uk/chebi/. The data is made available under the Creative Commons License (CC BY 3.0, http://creativecommons.org/licenses/by/3.0/). For more information see: Degtyarenko et al. (2008) ChEBI: a database and ontology for chemical entities of biological interest. Nucleic Acids Res. 36, D344–D350.
Term:cyclophosphamide hydrate
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Accession:CHEBI:4026 term browser browse the term
Definition:The monohydrate of cyclophosphamide.
Synonyms:exact_synonym: N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide hydrate;   N,N-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine 2-oxide--water (1/1)
 related_synonym: (+-)-2-(Bis(2-chloroethyl)amino)tetrahydro-2H-1,3,2-oxazaphosphorine 2-oxide monohydrate;   (Bis(chloro-2-ethyl)amino)-2-tetrahydro-3,4,5,6-oxazaphosphorine-1,3,2-oxide-2 monohydrate;   1-Bis(2-chloroethyl)amino-1-oxo-2-aza-5-oxaphosphoridine monohydrate;   2-(Bis(2-chloroethyl)amino)-1-oxa-3-aza-2-phosphocyclohexane 2-oxide monohydrate;   2-(Di(2-chloroethyl)amino)-1-oxa-3-aza-2-phosphacyclohexane-2-oxide monohydrate;   Bis(2-chloroethyl)phosphoramide cyclic propanolamide ester monohydrate;   Cyclophosphamide;   Cyclophosphamide monohydrate;   Formula=C7H15Cl2N2O2P.H2O;   Formula=C7H17Cl2N2O3P;   InChI=1S/C7H15Cl2N2O2P.H2O/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14;/h1-7H2,(H,10,12);1H2;   InChIKey=PWOQRKCAHTVFLB-UHFFFAOYSA-N;   N,N-Bis(2-chloroethyl)tetrahydro-2H-1,3,2-oxaphosphorin-2-amine, 2-oxide monohydrate;   N,N-Bis(beta-chloroethyl)-N',O-trimethylenephosphoric acid ester diamide monohydrate;   SMILES=O.ClCCN(CCCl)P1(=O)NCCCO1
 xref: Beilstein:8167897;   CAS:6055-19-2;   DrugBank:DB00531;   KEGG:D00287


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  CHEBI ontology 19848
    role 19824
      biological role 19822
        immunomodulator 15062
          immunosuppressive agent 13935
            cyclophosphamide hydrate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19848
    subatomic particle 19846
      composite particle 19846
        hadron 19846
          baryon 19846
            nucleon 19846
              atomic nucleus 19846
                atom 19846
                  main group element atom 19796
                    p-block element atom 19796
                      chalcogen 19552
                        oxygen atom 19527
                          oxygen molecular entity 19527
                            hydroxides 19334
                              oxoacid 18769
                                pnictogen oxoacid 14889
                                  phosphorus oxoacid 14481
                                    phosphoric acids 13919
                                      phosphoric acid 13919
                                        phosphoramide 1061
                                          phosphorodiamide 1010
                                            cyclophosphamide 765
                                              cyclophosphamide hydrate 0
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