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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:AACOCF3
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Accession:CHEBI:2341 term browser browse the term
Definition:A fatty acid derivative that is arachidonic acid in which the OH part of the carboxy group has been replaced by a trifluoromethyl group
Synonyms:exact_synonym: (6Z,9Z,12Z,15Z)-1,1,1-trifluorohenicosa-6,9,12,15-tetraen-2-one
 related_synonym: Arachidonic acid trifluoromethyl ketone;   Arachidonyl trifluoromethyl ketone;   Arachidonyltrifluoromethane;   Formula=C21H31F3O;   InChI=1S/C21H31F3O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(25)21(22,23)24/h6-7,9-10,12-13,15-16H,2-5,8,11,14,17-19H2,1H3/b7-6-,10-9-,13-12-,16-15-;   InChIKey=PLWROONZUDKYKG-DOFZRALJSA-N;   SMILES=CCCCC\\C=C/C\\C=C/C\\C=C/C\\C=C/CCCC(=O)C(F)(F)F
 xref: CAS:149301-79-1;   KEGG:C01397
 xref_mesh: MESH:C081565
 xref: Reaxys:7593118


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      atom 0
        nonmetal atom 0
          carbon atom 0
            organic molecular entity 0
              olefinic compound 0
                AACOCF3 0
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  CHEBI ontology 0
    subatomic particle 0
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          baryon 0
            nucleon 0
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                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
                                              fatty acid 20:4 0
                                                icosatetraenoic acid 0
                                                  icosa-5,8,11,14-tetraenoic acid 0
                                                    arachidonic acid 0
                                                      AACOCF3 0
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