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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:9-HOTrE(1-)
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Accession:CHEBI:77949 term browser browse the term
Definition:A polyunsaturated fatty acid anion that is the conjugate base of 9-HOTrE, obtained by deprotonation of the carboxy group; major species at pH 7.3.
Synonyms:exact_synonym: (10E,12Z,15Z)-9-hydroxyoctadeca-10,12,15-trienoate
 related_synonym: Formula=C18H29O3;   InChI=1S/C18H30O3/c1-2-3-4-5-6-8-11-14-17(19)15-12-9-7-10-13-16-18(20)21/h3-4,6,8,11,14,17,19H,2,5,7,9-10,12-13,15-16H2,1H3,(H,20,21)/p-1/b4-3-,8-6-,14-11+;   InChIKey=RIGGEAZDTKMXSI-CUHSZNQNSA-M;   SMILES=CC\\C=C/C\\C=C/C=C/C(O)CCCCCCCC([O-])=O
 cyclic_relationship: is_conjugate_base_of CHEBI:72625

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  CHEBI ontology 0
    chemical entity 0
      atom 0
        nonmetal atom 0
          carbon atom 0
            organic molecular entity 0
              lipid 0
                fatty acid anion 0
                  long-chain fatty acid anion 0
                    9-HOTrE(1-) 0
Path 2
Term Annotations click to browse term
  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
                                    fatty acid anion 0
                                      unsaturated fatty acid anion 0
                                        polyunsaturated fatty acid anion 0
                                          9-HOTrE(1-) 0
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