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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 21720
    role 21698
      biological role 21696
        biochemical role 20920
          metabolite 20873
            eukaryotic metabolite 20732
              plant metabolite 18567
                linoleate 0
                  (9S),10-epoxy-(10,12Z)-octadecadienoate 0
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  CHEBI ontology 21720
    subatomic particle 21705
      composite particle 21705
        hadron 21705
          baryon 21705
            nucleon 21705
              atomic nucleus 21705
                atom 21705
                  main group element atom 21622
                    p-block element atom 21622
                      carbon group element atom 21427
                        carbon atom 21326
                          organic molecular entity 21326
                            organic ion 8614
                              organic anion 3088
                                carboxylic acid anion 2433
                                  monocarboxylic acid anion 1509
                                    fatty acid anion 105
                                      unsaturated fatty acid anion 1
                                        octadecanoid anion 0
                                          HPODE(1-) 0
                                            9-HPODE(1-) 0
                                              linoleate 0
                                                (9S),10-epoxy-(10,12Z)-octadecadienoate 0
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