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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:1,1-bis(2-aminoethyl)-2-hydroxy-3-oxotriazane
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Accession:CHEBI:50154 term browser browse the term
Definition:A nitroso compound that is triazane in which the the nitrogen at position 1 is substituted by two 2-aminoethyl groups, that at position 2 is substituted by a hydroxy group, and that at position 3 is substituted by an oxo group.
Synonyms:related_synonym: 2,2'-(hydroxynitrosohydrazino)bis-ethanamine;   DETA NONOate;   Formula=C4H13N5O2;   InChI=1S/C4H13N5O2/c5-1-3-8(4-2-6)9(11)7-10/h11H,1-6H2;   InChIKey=HMRRJTFDJAVRMR-UHFFFAOYSA-N;   NOC-18;   SMILES=NCCN(CCN)N(O)N=O;   diethylenetriamine NONOate
 xref: Beilstein:8139626;   CAS:146724-94-9
 xref_mesh: MESH:C094210
 xref: PMID:10471084;   PMID:12924710;   PMID:16378139;   PMID:18512047;   PMID:19785659;   PMID:19935078;   PMID:20173509;   Reaxys:8139626



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  CHEBI ontology 501
    role 501
      chemical role 426
        donor 401
          nitric oxide donor 4
            1,1-bis(2-aminoethyl)-2-hydroxy-3-oxotriazane 0
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  CHEBI ontology 501
    subatomic particle 501
      composite particle 501
        hadron 501
          baryon 501
            nucleon 501
              atomic nucleus 501
                atom 501
                  main group element atom 494
                    main group molecular entity 494
                      s-block molecular entity 438
                        hydrogen molecular entity 437
                          hydrides 368
                            inorganic hydride 333
                              pnictogen hydride 332
                                nitrogen hydride 332
                                  azane 327
                                    ammonia 327
                                      organic amino compound 327
                                        tertiary amino compound 177
                                          1,1-bis(2-aminoethyl)-2-hydroxy-3-oxotriazane 0
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