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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:3-nitrotoluene
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Accession:CHEBI:39931 term browser browse the term
Definition:A mononitrotoluene carrying a nitro group at position 3.
Synonyms:related_synonym: 1-methyl-3-nitrobenzene;   3-Nitrotoluol;   Formula=C7H7NO2;   InChI=1S/C7H7NO2/c1-6-3-2-4-7(5-6)8(9)10/h2-5H,1H3;   InChIKey=QZYHIOPPLUPUJF-UHFFFAOYSA-N;   SMILES=Cc1cccc(c1)[N+]([O-])=O;   m-Nitrotoluol;   m-methylnitrobenzene;   m-nitrotoluene;   meta-Nitrotoluol
 alt_id: CHEBI:35228;   CHEBI:39924
 xref: Beilstein:1906910;   CAS:99-08-1;   Gmelin:279176;   KEGG:C19486;   PDBeChem:3NT;   PMID:23212174;   PMID:23250222;   Reaxys:1906910;   Wikipedia:3-Nitrotoluene

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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    chemical entity 0
      molecular entity 0
        polyatomic entity 0
          molecule 0
            organic molecule 0
              C-nitro compound 0
                nitrotoluene 0
                  mononitrotoluene 0
                    3-nitrotoluene 0
Path 2
Term Annotations click to browse term
  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
                                          mononitrotoluene 0
                                            3-nitrotoluene 0
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