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ONTOLOGY REPORT - ANNOTATIONS


Term:4-(2,4-dichlorophenoxy)butanoate
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Accession:CHEBI:143277 term browser browse the term
Definition:A monocarboxylic acid anion resulting from the dprotonation of the carboxy group of 4-(2,4-dichlorophenoxy)butanoic acid (2,4-DB). The major species at pH 7.3.
Synonyms:related_synonym: 2,4-DB(1-);   4-(2,4-dichlorophenoxy)butyrate;   Formula=C10H9Cl2O3;   InChI=1S/C10H10Cl2O3/c11-7-3-4-9(8(12)6-7)15-5-1-2-10(13)14/h3-4,6H,1-2,5H2,(H,13,14)/p-1;   InChIKey=YIVXMZJTEQBPQO-UHFFFAOYSA-M;   SMILES=C=1C=C(C=C(C1OCCCC([O-])=O)Cl)Cl
 xref: PMID:12801099 "Europe PMC";   PMID:19435093 "Europe PMC"
 cyclic_relationship: is_conjugate_base_of CHEBI:73173


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  CHEBI ontology 21038
    role 21018
      application 20451
        agrochemical 13549
          4-(2,4-dichlorophenoxy)butanoate 0
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  CHEBI ontology 21038
    subatomic particle 21032
      composite particle 21032
        hadron 21032
          baryon 21032
            nucleon 21032
              atomic nucleus 21032
                atom 21032
                  main group element atom 20874
                    p-block element atom 20874
                      carbon group element atom 20609
                        carbon atom 20586
                          organic molecular entity 20586
                            organic ion 8026
                              organic anion 2257
                                carboxylic acid anion 1847
                                  monocarboxylic acid anion 1502
                                    4-(2,4-dichlorophenoxy)butanoate 0
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