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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:(9S),10-epoxy-(10,12Z)-octadecadienoate
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Accession:CHEBI:143139 term browser browse the term
Definition:A long-chain unsaturated fatty acid anion that is the conjugate base of (9S),10-epoxy-(10,12Z)-octadecadienoic acid, arising from deprotonation of the carboxylic acid group.
Synonyms:exact_synonym: 8-{(2S)-3-[(2Z)-oct-2-en-1-ylidene]oxiran-2-yl}octanoate
 related_synonym: (9S),10-epoxy-(10,12Z)-octadecadienoic acid(1-);   Formula=C18H29O3;   InChI=1S/C18H30O3/c1-2-3-4-5-7-10-13-16-17(21-16)14-11-8-6-9-12-15-18(19)20/h7,10,13,17H,2-6,8-9,11-12,14-15H2,1H3,(H,19,20)/p-1/b10-7-,16-13-/t17-/m0/s1;   InChIKey=LVVCDOSOKGYQFY-IDQNXFEJSA-M;   SMILES=C([O-])(=O)CCCCCCC[C@H]1C(=C(/C=C\\CCCCC)[H])O1
 xref: PMID:17046828
 cyclic_relationship: is_conjugate_base_of CHEBI:143790


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  CHEBI ontology 885
    role 865
      biological role 865
        biochemical role 729
          metabolite 717
            eukaryotic metabolite 691
              plant metabolite 402
                linoleate 0
                  (9S),10-epoxy-(10,12Z)-octadecadienoate 0
Path 2
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  CHEBI ontology 885
    subatomic particle 870
      composite particle 870
        hadron 870
          baryon 870
            nucleon 870
              atomic nucleus 870
                atom 870
                  main group element atom 860
                    p-block element atom 857
                      carbon group element atom 833
                        carbon atom 832
                          organic molecular entity 832
                            organic ion 56
                              organic anion 20
                                carboxylic acid anion 18
                                  monocarboxylic acid anion 8
                                    fatty acid anion 1
                                      unsaturated fatty acid anion 0
                                        octadecanoid anion 0
                                          HPODE(1-) 0
                                            9-HPODE(1-) 0
                                              linoleate 0
                                                (9S),10-epoxy-(10,12Z)-octadecadienoate 0
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