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ONTOLOGY REPORT - ANNOTATIONS


Term:2,4,6-trinitrotoluene
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Accession:CHEBI:46053 term browser browse the term
Definition:A trinitrotoluene having the nitro groups at positions 2, 4 and 6.
Synonyms:related_synonym: 1-methyl-2,4,6-trinitrobenzene;   2,4,6-TNT;   2,4,6-Trinitrotoluol;   2-methyl-1,3,5-trinitrobenzene;   Formula=C7H5N3O6;   InChI=1S/C7H5N3O6/c1-4-6(9(13)14)2-5(8(11)12)3-7(4)10(15)16/h2-3H,1H3;   InChIKey=SPSSULHKWOKEEL-UHFFFAOYSA-N;   SMILES=Cc1c(cc(cc1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O;   TNT;   Trinitrotoluen;   Trinitrotoluol;   Tritol;   Trotyl;   alpha-TNT;   s-Trinitrotoluol;   s-trinitrotoluene;   sym-Trinitrotoluol;   trinitrotoluene
 alt_id: CHEBI:19337;   CHEBI:46051
 xref: Beilstein:1887900 "Beilstein";   CAS:118-96-7 "ChemIDplus";   CAS:118-96-7 "KEGG COMPOUND";   CAS:118-96-7 "NIST Chemistry WebBook";   DrugBank:DB01676;   KEGG:C16391
 xref_mesh: MESH:D014303
 xref: PDBeChem:TNL;   PMID:19427119 "Europe PMC";   PMID:20219247 "Europe PMC";   PMID:28845964 "Europe PMC";   Reaxys:1887900 "Reaxys";   Wikipedia:Trinitrotoluene


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  CHEBI ontology 0
    role 0
      chemical role 0
        explosive 0
          2,4,6-trinitrotoluene 0
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  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic molecule 0
                              organic cyclic compound 0
                                carbocyclic compound 0
                                  benzenoid aromatic compound 0
                                    benzenes 0
                                      toluenes 0
                                        nitrotoluene 0
                                          trinitrotoluene 0
                                            2,4,6-trinitrotoluene 0
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RGD is funded by grant HL64541 from the National Heart, Lung, and Blood Institute on behalf of the NIH.