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The Chemical Entities of Biological Interest (ChEBI) ontology is downloaded weekly from EMBL-EBI at The data is made available under the Creative Commons License (CC 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.

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Accession:CHEBI:85928 term browser browse the term
Definition:A nitrile that is acrylonitrile in which the hydrogen located beta,trans to the cyano group is replaced by a tosyl group. It is an inhibitor of cytokine-induced IkappaB-alpha phosphorylation in cells.
Synonyms:exact_synonym: (2E)-3-[(4-methylphenyl)sulfonyl]acrylonitrile
 related_synonym: (3E)3-(p-toluenesulfonyl)acrylonitrile;   (E)-3-(4-methylphenylsulfonyl)-2-propenenenitrile;   (E)-3-(p-toluenesulfonyl)acrylonitrile;   BAY-11-7082;   BAY-11-7821;   BAY-117821;   Bay-117082;   Formula=C10H9NO2S;   InChI=1S/C10H9NO2S/c1-9-3-5-10(6-4-9)14(12,13)8-2-7-11/h2-6,8H,1H3/b8-2+;   InChIKey=DOEWDSDBFRHVAP-KRXBUXKQSA-N;   SMILES=Cc1ccc(cc1)S(=O)(=O)\\C=C\\C#N;   beta-(cyanovinyl)-p-tolylsulfone
 xref: CAS:19542-67-7;   PMID:12176906;   PMID:15755516;   PMID:16142309;   PMID:18471963;   PMID:19913011;   PMID:19958360;   PMID:20093358;   PMID:21325821;   PMID:22342224;   PMID:22572606;   PMID:22745523;   PMID:23441730;   PMID:23527154;   PMID:23578302;   PMID:23846545;   PMID:25704036;   PMID:25759022;   Reaxys:2049371

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Term Annotations click to browse term
  CHEBI ontology 19781
    role 19726
      biological role 19726
        biochemical role 19319
          apoptosis inducer 11028
            (E)-3-tosylacrylonitrile 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19781
    subatomic particle 19779
      composite particle 19779
        hadron 19779
          baryon 19779
            nucleon 19779
              atomic nucleus 19779
                atom 19779
                  main group element atom 19669
                    p-block element atom 19669
                      carbon group element atom 19588
                        carbon atom 19578
                          organic molecular entity 19578
                            one-carbon compound 17596
                              hydrogen cyanide 3031
                                cyanides 3031
                                  nitrile 3027
                                    (E)-3-tosylacrylonitrile 0
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