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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:phenoxyacetic acid
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Accession:CHEBI:8075 term browser browse the term
Definition:A monocarboxylic acid that is the O-phenyl derivative of glycolic acid. A metabolite of 2-phenoxyethanol, it is used in the manufacture of pharmaceuticals, pesticides, fungicides and dyes.
Synonyms:related_synonym: Glycol acid phenyl ether;   POA;   Phenoxyacetate;   Phenoxyessigsaeure;   phenoxacetic acid;   phenoxyethanoic acid
 xref: CAS:122-59-8;   Gmelin:142730;   HMDB:HMDB0031609;   Reaxys:907949;   kegg.compound:C02181;   pdb-ccd:06Y;   pubmed:14687482;   pubmed:23838187;   pubmed:26188115;   pubmed:26452788
 chemrof_formula: C8H8O3
 chemrof_inchi: InChI=1S/C8H8O3/c9-8(10)6-11-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10)
 chemrof_inchikey: LCPDWSOZIOUXRV-UHFFFAOYSA-N
 chemrof_smiles: O=C(O)COc1ccccc1
 cyclic_relationship: has_functional_parent CHEBI:17497;   is_conjugate_acid_of CHEBI:38846


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Path 1
Term Annotations click to browse term
  CHEBI ontology 20874
    role 20844
      biological role 20831
        aetiopathogenetic role 19572
          allergen 16217
            phenoxyacetic acid 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 20874
    subatomic particle 20883
      composite particle 20883
        hadron 20872
          baryon 20883
            nucleon 20872
              atomic nucleus 20883
                atom 20872
                  main group element atom 20796
                    p-block element atom 20796
                      carbon group element atom 20712
                        carbon atom 20706
                          organic molecular entity 20706
                            heteroorganic entity 20201
                              organochalcogen compound 19822
                                organooxygen compound 19713
                                  carbon oxoacid 17678
                                    carboxylic acid 17675
                                      monocarboxylic acid 17142
                                        phenoxyacetic acid 0
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