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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(R)-HPODE
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Accession:CHEBI:63331 term browser browse the term
Definition:An HPODE (hydroperoxy-octadecadienoic acid) in which the double bonds are at positions 10 and 12 (E and Z geometry, respectively) and the hydroperoxy group is at position 9 (R configuration).
Synonyms:exact_synonym: (9R,10E,12Z)-9-hydroperoxyoctadeca-10,12-dienoic acid
 related_synonym: (9R,10E,12Z)-9-hydroperoxy-10,12-octadecadienoic acid;   Formula=C18H32O4;   InChI=1S/C18H32O4/c1-2-3-4-5-6-8-11-14-17(22-21)15-12-9-7-10-13-16-18(19)20/h6,8,11,14,17,21H,2-5,7,9-10,12-13,15-16H2,1H3,(H,19,20)/b8-6-,14-11+/t17-/m0/s1;   InChIKey=JGUNZIWGNMQSBM-WXUVIADPSA-N;   SMILES=CCCCC\\C=C/C=C/[C@@H](CCCCCCCC(O)=O)OO
 xref: PMID:18031288;   PMID:18439634;   PMID:20043865;   Reaxys:18880808
 cyclic_relationship: is_conjugate_acid_of CHEBI:63323;   is_enantiomer_of CHEBI:34498


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  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          metabolite 0
            eukaryotic metabolite 0
              plant metabolite 0
                linoleic acid 0
                  HPODE 0
                    9(R)-HPODE 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
                            heteroorganic entity 0
                              organochalcogen compound 0
                                organooxygen compound 0
                                  carbon oxoacid 0
                                    carboxylic acid 0
                                      monocarboxylic acid 0
                                        fatty acid 0
                                          unsaturated fatty acid 0
                                            polyunsaturated fatty acid 0
                                              essential fatty acid 0
                                                omega-6 fatty acid 0
                                                  linoleic acid 0
                                                    HPODE 0
                                                      9(R)-HPODE 0
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