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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:triphenylsulfonium 4-oxo-1-adamantyloxycarbonyldifluoromethanesulfonate
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Accession:CHEBI:48454 term browser browse the term
Definition:An organic salt that has formula C30H28F2O6S2.
Synonyms:exact_synonym: triphenylsulfonium 1,1-difluoro-2-oxo-2-[(4-oxoadamantan-1-yl)oxy]ethanesulfonate
 related_synonym: Formula=C30H28F2O6S2;   InChI=1S/C18H15S.C12H14F2O6S/c1-4-10-16(11-5-1)19(17-12-6-2-7-13-17)18-14-8-3-9-15-18;13-12(14,21(17,18)19)10(16)20-11-3-6-1-7(4-11)9(15)8(2-6)5-11/h1-15H;6-8H,1-5H2,(H,17,18,19)/q+1;/p-1;   InChIKey=BAHMOGUQNNDZRT-UHFFFAOYSA-M;   SMILES=c1ccc(cc1)[S+](c1ccccc1)c1ccccc1.[O-]S(=O)(=O)C(F)(F)C(=O)OC12CC3CC(C1)C(=O)C(C3)C2
 xref: Patent:EP1873143


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Term Annotations click to browse term
  CHEBI ontology 19831
    chemical entity 19829
      molecular entity 19829
        ion 16707
          anion 16084
            salt 15746
              organic salt 3294
                triphenylsulfonium 4-oxo-1-adamantyloxycarbonyldifluoromethanesulfonate 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19831
    subatomic particle 19829
      composite particle 19829
        hadron 19829
          baryon 19829
            nucleon 19829
              atomic nucleus 19829
                atom 19829
                  main group element atom 19779
                    main group molecular entity 19779
                      s-block molecular entity 19617
                        hydrogen molecular entity 19604
                          hydrides 19102
                            organic hydride 18674
                              organic fundamental parent 18674
                                hydrocarbon 18410
                                  cyclic hydrocarbon 17225
                                    polycyclic hydrocarbon 17035
                                      polycyclic alkane 42
                                        adamantane 42
                                          adamantanones 0
                                            idramantone 0
                                              triphenylsulfonium 4-oxo-1-adamantyloxycarbonyldifluoromethanesulfonate 0
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