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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:tridihexethyl bromide
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Accession:CHEBI:9702 term browser browse the term
Definition:An organic bromide salt that has formula C21H36NO.Br.
Synonyms:exact_synonym: 3-cyclohexyl-N,N,N-triethyl-3-hydroxy-3-phenylpropan-1-aminium bromide
 related_synonym: Formula=C21H36NO.Br;   InChI=1S/C21H36NO.BrH/c1-4-22(5-2,6-3)18-17-21(23,19-13-9-7-10-14-19)20-15-11-8-12-16-20;/h7,9-10,13-14,20,23H,4-6,8,11-12,15-18H2,1-3H3;1H/q+1;/p-1;   InChIKey=NXKAZKHSCKBZCB-UHFFFAOYSA-M;   SMILES=[Br-].CC[N+](CC)(CC)CCC(O)(C1CCCCC1)c1ccccc1
 xref: Beilstein:3804036;   DrugBank:DB00505;   KEGG:C11761


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Path 1
Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      application 21744
        pharmaceutical 21187
          drug 21159
            anti-ulcer drug 1183
              tridihexethyl 0
                tridihexethyl bromide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 22178
    subatomic particle 22170
      composite particle 22170
        hadron 22201
          baryon 22170
            nucleon 22170
              atomic nucleus 22170
                atom 22170
                  main group element atom 22104
                    main group molecular entity 22104
                      s-block molecular entity 21729
                        hydrogen molecular entity 21646
                          hydrides 20758
                            inorganic hydride 18672
                              pnictogen hydride 18652
                                nitrogen hydride 18519
                                  ammonium 8211
                                    ammonium ion derivative 8196
                                      quaternary ammonium ion 5407
                                        tridihexethyl 0
                                          tridihexethyl bromide 0
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