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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:2,3,5-trichloro-cis,cis-muconate(2-)
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Accession:CHEBI:19298 term browser browse the term
Definition:A chlorocarboxylic acid anion that has formula C6HCl3O4.
Synonyms:exact_synonym: (2Z,4E)-2,3,5-trichlorohexa-2,4-dienedioate
 related_synonym: (2Z,4E)-2,3,5-trichloromuconate;   2,3,5-trichloro-cis,cis-muconate;   Formula=C6HCl3O4;   InChI=1S/C6H3Cl3O4/c7-2(4(9)6(12)13)1-3(8)5(10)11/h1H,(H,10,11)(H,12,13)/p-2/b3-1+,4-2-;   InChIKey=AHDWVTPNJCBFTN-TZFCGSKZSA-L;   SMILES=[O-]C(=O)C(\\Cl)=C/C(Cl)=C(/Cl)C([O-])=O
 xref: KEGG:C12833;   UM-BBD_compID:c0487
 cyclic_relationship: is_conjugate_base_of CHEBI:38427


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22194
    role 22179
      biological role 22178
        biochemical role 21449
          metabolite 21397
            xenobiotic metabolite 15980
              bacterial xenobiotic metabolite 4168
                cis,cis-muconate 0
                  2,3,5-trichloro-cis,cis-muconate(2-) 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22194
    subatomic particle 22186
      composite particle 22186
        hadron 22186
          baryon 22186
            nucleon 22186
              atomic nucleus 22186
                atom 22186
                  main group element atom 22120
                    p-block element atom 22120
                      carbon group element atom 21920
                        carbon atom 21846
                          organic molecular entity 21846
                            organic ion 10082
                              organic anion 3684
                                carboxylic acid anion 2523
                                  dicarboxylic acid anion 249
                                    dicarboxylic acid dianion 249
                                      polyunsaturated dicarboxylic acid dianion 0
                                        hexadienedioate 0
                                          muconate 0
                                            cis,cis-muconate 0
                                              2,3,5-trichloro-cis,cis-muconate(2-) 0
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