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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 iodide
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Accession:CHEBI:9704 term browser browse the term
Definition:An organic iodide salt that has formula C21H36NO.I.
Synonyms:exact_synonym: 3-cyclohexyl-N,N,N-triethyl-3-hydroxy-3-phenylpropan-1-aminium iodide
 related_synonym: (3-Cyclohexyl-3-hydroxy-3-phenylpropyl)triethylammonium iodide;   3-Diethylamino-1-phenyl-1-cyclohexyl-1-propanol ethiodide;   Formula=C21H36NO.I;   InChI=1S/C21H36NO.HI/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=VFEDLMLHAGASHB-UHFFFAOYSA-M;   Propethonum iodide;   SMILES=[I-].CC[N+](CC)(CC)CCC(O)(C1CCCCC1)c1ccccc1;   Trihexethyl iodide;   alpha-(2-Diethylaminoethyl)-alpha-phenylcyclohexanemethanol ethiodide;   iodure de tridihexethyl;   ioduro de tridihexetilo;   tridihexethyli iodidum
 xref: Beilstein:3802106;   CAS:125-99-5;   DrugBank:DB00505;   KEGG:C07862;   Patent:US2913494


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Path 1
Term Annotations click to browse term
  CHEBI ontology 19786
    role 19732
      application 19423
        pharmaceutical 19321
          drug 19321
            anti-ulcer drug 790
              tridihexethyl 0
                tridihexethyl iodide 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 19786
    subatomic particle 19784
      composite particle 19784
        hadron 19784
          baryon 19784
            nucleon 19784
              atomic nucleus 19784
                atom 19784
                  main group element atom 19675
                    main group molecular entity 19675
                      s-block molecular entity 19443
                        hydrogen molecular entity 19439
                          hydrides 18763
                            inorganic hydride 17484
                              pnictogen hydride 17461
                                nitrogen hydride 17315
                                  ammonium 8224
                                    ammonium ion derivative 8220
                                      quaternary ammonium ion 5110
                                        tridihexethyl 0
                                          tridihexethyl iodide 0
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