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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:N-nitrosodiethylamine
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Accession:CHEBI:34873 term browser browse the term
Definition:A nitrosamine that is N-ethylethanamine substituted by a nitroso group at the N-atom.
Synonyms:exact_synonym: N-ethyl-N-nitrosoethanamine
 related_synonym: 1,1-diethyl-2-oxohydrazine;   DANA;   DEN;   Diethylnitrosamine;   Formula=C4H10N2O;   InChI=1S/C4H10N2O/c1-3-6(4-2)5-7/h3-4H2,1-2H3;   InChIKey=WBNQDOYYEUMPFS-UHFFFAOYSA-N;   N,N-diethylnitrosamine;   N,N-diethylnitrosoamine;   NDEA;   SMILES=CCN(CC)N=O;   diethylnitrosoamine
 xref: CAS:55-18-5;   KEGG:C14422
 xref_mesh: MESH:D004052
 xref: PMID:24696076;   PMID:24755254;   Reaxys:1744991



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  • Term paths to the root
    Path 1
    Term Annotations click to browse term
      CHEBI ontology 20873
        role 20805
          biological role 20829
            aetiopathogenetic role 19865
              hepatotoxic agent 16616
                N-nitrosodiethylamine 3299
                  N-ethyl-N-(2-hydroxyethyl)nitrosamine 1
    Path 2
    Term Annotations click to browse term
      CHEBI ontology 20873
        subatomic particle 20871
          composite particle 20871
            hadron 20871
              baryon 20871
                nucleon 20871
                  atomic nucleus 20871
                    atom 20871
                      main group element atom 20794
                        p-block element atom 20794
                          p-block molecular entity 20794
                            pnictogen molecular entity 19692
                              nitrogen molecular entity 19597
                                nitroso compound 5492
                                  nitrosamine 3890
                                    N-nitrosodiethylamine 3299
                                      N-ethyl-N-(2-hydroxyethyl)nitrosamine 1
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