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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:homogentisate
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Accession:CHEBI:16169 term browser browse the term
Definition:A dihydroxy monocarboxylic acid anion that is the conjugate base of (2,6-dihydroxyphenyl)acetic (homogentisic) acid, arising from deprotonation of the carboxy group.
Synonyms:exact_synonym: (2,5-dihydroxyphenyl)acetate
 related_synonym: Formula=C8H7O4;   InChI=1S/C8H8O4/c9-6-1-2-7(10)5(3-6)4-8(11)12/h1-3,9-10H,4H2,(H,11,12)/p-1;   InChIKey=IGMNYECMUMZDDF-UHFFFAOYSA-M;   SMILES=Oc1ccc(O)c(CC([O-])=O)c1
 alt_id: CHEBI:11452;   CHEBI:14410;   CHEBI:24615
 xref: Beilstein:3668593;   KEGG:C00544;   Reaxys:3668593;   UM-BBD_compID:c0108
 cyclic_relationship: is_conjugate_base_of CHEBI:44747

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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            eukaryotic metabolite 0
              plant metabolite 0
                homogentisate 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 ion 0
                              organic anion 0
                                carboxylic acid anion 0
                                  monocarboxylic acid anion 0
                                    acetate 0
                                      homogentisate 0
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