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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:bethanechol chloride
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Accession:CHEBI:3085 term browser browse the term
Definition:The chloride salt of bethanechol. A slowly hydrolysed muscarinic agonist with no nicotinic effects, it is used to increase smooth muscle tone, as in the gastrointestinal tract following abdominal surgery, treatment of gastro-oesophageal reflux disease, and as an alternative to catheterisation in the treatment of non-obstructive urinary retention.
Synonyms:exact_synonym: 2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium chloride
 related_synonym: (2-hydroxypropyl)trimethylammonium chloride carbamate;   2-((aminocarbonyl)oxy)-N,N,N-trimethyl-1-propanaminium chloride;   2-carbamoyloxypropyltrimethylammonium chloride;   Formula=C7H17ClN2O2;   InChI=1S/C7H16N2O2.ClH/c1-6(11-7(8)10)5-9(2,3)4;/h6H,5H2,1-4H3,(H-,8,10);1H;   InChIKey=XXRMYXBSBOVVBH-UHFFFAOYSA-N;   SMILES=[Cl-].CC(C[N+](C)(C)C)OC(N)=O;   trimethyl(2-carbamoyloxypropyl)ammonium chloride
 xref: Beilstein:3731819;   CAS:590-63-6;   DrugBank:DB01019;   KEGG:D01000;   Patent:US1894162;   Patent:US2322375;   Wikipedia:Bethanechol


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Path 1
Term Annotations click to browse term
  CHEBI ontology 0
    role 0
      biological role 0
        biochemical role 0
          cofactor 0
            chloride 0
              chloride salt 0
                bethanechol chloride 0
                  (R)-bethanechol chloride 0
                  (S)-bethanechol chloride 0
Path 2
Term Annotations click to browse term
  CHEBI ontology 0
    subatomic particle 0
      composite particle 0
        hadron 0
          baryon 0
            nucleon 0
              atomic nucleus 0
                atom 0
                  main group element atom 0
                    p-block element atom 0
                      carbon group element atom 0
                        carbon atom 0
                          organic molecular entity 0
                            organic group 0
                              organic divalent group 0
                                organodiyl group 0
                                  carbonyl group 0
                                    carbonyl compound 0
                                      carboxylic ester 0
                                        carbamate ester 0
                                          bethanechol 0
                                            bethanechol chloride 0
                                              (R)-bethanechol chloride 0
                                              (S)-bethanechol chloride 0
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