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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:alpha-licanic acid
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Accession:CHEBI:28771 term browser browse the term
Definition:A trienoic fatty acid comprising alpha-eleostearic acid having a 4-oxo substituent.
Synonyms:related_synonym: (9Z,11E,13E)-4-Oxooctadeca-9,11,13-trienoic acid;   (Z,E,E)-4-oxooctadeca-9,11,13-trienoic acid;   4-Oxo-9,11,13-octadecatrienoic acid;   4-Oxo-9c,11t,13t-octadecatriensaeure;   4-Oxo-cis-9,trans-11,trans-13-octadecatrienoic acid;   4-Oxo-cis9,trans11,trans13-octadecatrienoic acid;   4-Oxo-octadeca-9c,11t,13t-triensaeure;   4-oxo-octadeca-9c,11t,13t-trienoic acid;   Formula=C18H28O3;   InChI=1S/C18H28O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17(19)15-16-18(20)21/h5-10H,2-4,11-16H2,1H3,(H,20,21)/b6-5+,8-7+,10-9-;   InChIKey=DTRGDWOPRCXRET-WPOADVJFSA-N;   SMILES=CCCC\\C=C\\C=C\\C=C/CCCCC(=O)CCC(O)=O;   alpha-Licansaeure
 alt_id: CHEBI:10297;   CHEBI:22461
 xref: CAS:623-99-4;   KEGG:C08319;   KNApSAcK:C00001222;   LIPID_MAPS_instance:LMFA01060175;   Reaxys:1728462


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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 0
                  long-chain fatty acid 0
                    alpha-licanic acid 0
Path 2
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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
                                              trienoic fatty acid 0
                                                fatty acid 18:3 0
                                                  octadecatrienoic acid 0
                                                    conjugated linolenic acid 0
                                                      9,11,13-octadecatrienoic acid 0
                                                        (9Z,11E,13E)-octadeca-9,11,13-trienoic acid 0
                                                          alpha-licanic acid 0
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