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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:4,6-dinitro-o-cresol
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Accession:CHEBI:39349 term browser browse the term
Definition:A hydroxytoluene that is o-cresol carrying nitro substituents at positions 4 and 6.
Synonyms:related_synonym: 2,4-Dinitro-6-methylphenol;   3,5-dinitro-2-hydroxytoluene;   6-methyl-2,4-dinitrophenol;   Antinonnin;   DNOC;   Formula=C7H6N2O5;   InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3;   InChIKey=ZXVONLUNISGICL-UHFFFAOYSA-N;   SMILES=Cc1cc(cc(c1O)[N+]([O-])=O)[N+]([O-])=O
 xref: Beilstein:2054389;   CAS:534-52-1;   KEGG:C18653;   PMID:11775154;   PMID:1960763;   PPDB:261;   Reaxys:2054389



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Term Annotations click to browse term
  CHEBI ontology 25538
    role 25475
      application 24658
        pesticide 19793
          fungicide 12351
            4,6-dinitro-o-cresol 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 25538
    subatomic particle 25509
      composite particle 25509
        hadron 25509
          baryon 25509
            nucleon 25509
              atomic nucleus 25509
                atom 25509
                  main group element atom 25358
                    p-block element atom 25358
                      carbon group element atom 24926
                        carbon atom 24902
                          organic molecular entity 24902
                            organic molecule 24758
                              organic cyclic compound 24105
                                carbocyclic compound 21780
                                  benzenoid aromatic compound 19634
                                    benzenes 19265
                                      toluenes 7291
                                        hydroxytoluene 1917
                                          cresol 1911
                                            o-cresol 13
                                              4,6-dinitro-o-cresol 0
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