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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:5,5-dimethyl-2-[(trifluoromethyl)sulfanyl]-1,3-cyclohexanedione
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Accession:CHEBI:228779 term browser browse the term
Synonyms:exact_synonym: 5,5-dimethyl-2-(triluoromethylsulanyl)cyclohexane-1,3-dione
 related_synonym: Formula=C9H11F3O2S;   InChI=1S/C9H11F3O2S/c1-8(2)3-5(13)7(6(14)4-8)15-9(10,11)12/h7H,3-4H2,1-2H3;   InChIKey=YDOQORTWZHTGLJ-UHFFFAOYSA-N;   SMILES=S(C1C(=O)CC(CC1=O)(C)C)C(F)(F)F
 xref: Chemspider:524584


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Term paths to the root
Path 1
Term Annotations click to browse term
  CHEBI ontology 19811
    chemical entity 19840
      group 19768
        inorganic group 19361
          oxo group 18858
            organic oxo compound 18858
              carbonyl compound 18858
                ketone 17163
                  diketone 1262
                    beta-diketone 950
                      5,5-dimethyl-2-[(trifluoromethyl)sulfanyl]-1,3-cyclohexanedione 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19811
    subatomic particle 19809
      composite particle 19809
        hadron 19840
          baryon 19809
            nucleon 19809
              atomic nucleus 19809
                atom 19809
                  main group element atom 19759
                    p-block element atom 19759
                      carbon group element atom 19708
                        carbon atom 19734
                          organic molecular entity 19705
                            heteroorganic entity 19459
                              organochalcogen compound 19222
                                organooxygen compound 19137
                                  carbonyl compound 18858
                                    ketone 17163
                                      diketone 1262
                                        beta-diketone 950
                                          5,5-dimethyl-2-[(trifluoromethyl)sulfanyl]-1,3-cyclohexanedione 0
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