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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:3,5,6-trichloropyridine-2-one
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Accession:CHEBI:83490 term browser browse the term
Definition:A pyridone that is pyridin-2(1H)-one substituted by chloro groups at positions 3, 5 and 6. It is a metabolite of the agrochemical chlorpyrifos.
Synonyms:exact_synonym: 3,5,6-trichloropyridin-2(1H)-one
 related_synonym: 3,5,6-trichloro-2-pyridin-2-one;   Formula=C5H2Cl3NO;   InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10);   InChIKey=WCYYAQFQZQEUEN-UHFFFAOYSA-N;   SMILES=Clc1cc(Cl)c(=O)[nH]c1Cl
 xref: CAS:6515-38-4
 xref_mesh: MESH:C012587
 xref: Reaxys:1448677
 cyclic_relationship: is_tautomer_of CHEBI:143794

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            xenobiotic metabolite 0
              marine xenobiotic metabolite 0
                3,5,6-trichloropyridine-2-one 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
                                organic heterocyclic compound 0
                                  organic heteromonocyclic compound 0
                                    pyridines 0
                                      pyridone 0
                                        3,5,6-trichloropyridine-2-one 0
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