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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:2,4-diamino-6-nitrotoluene
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Accession:CHEBI:19342 term browser browse the term
Definition:A member of the class of amino-nitrotoluenes that is 2,4-diaminotoluene bearing a nitro substituent at position 6.
Synonyms:exact_synonym: 4-methyl-5-nitrobenzene-1,3-diamine
 related_synonym: 2-Nitro-4,6-diaminotoluene;   Formula=C7H9N3O2;   InChI=1S/C7H9N3O2/c1-4-6(9)2-5(8)3-7(4)10(11)12/h2-3H,8-9H2,1H3;   InChIKey=DFZSBQYOXAUYCB-UHFFFAOYSA-N;   SMILES=Cc1c(N)cc(N)cc1[N+]([O-])=O
 xref: CAS:6629-29-4;   HMDB:HMDB0060362;   KEGG:C16396;   Reaxys:3049869


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19921
    role 19893
      biological role 19891
        biochemical role 19598
          metabolite 19585
            xenobiotic metabolite 16170
              2,4-diamino-6-nitrotoluene 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19921
    subatomic particle 19919
      composite particle 19919
        hadron 19919
          baryon 19919
            nucleon 19919
              atomic nucleus 19919
                atom 19919
                  main group element atom 19865
                    main group molecular entity 19865
                      s-block molecular entity 19697
                        hydrogen molecular entity 19678
                          hydrides 19184
                            inorganic hydride 18194
                              pnictogen hydride 18184
                                nitrogen hydride 18096
                                  azane 17900
                                    ammonia 17899
                                      organic amino compound 17899
                                        aromatic amine 15494
                                          anilines 14429
                                            substituted aniline 14069
                                              amino-nitrotoluene 580
                                                2,4-diamino-6-nitrotoluene 0
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