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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:benzatropine mesylate
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Accession:CHEBI:3049 term browser browse the term
Definition:The methanesulfonate salt of benzatropine. An acetylcholine receptor antagonist, it is used in the treatment of Parkinson's disease, and to reduce parkinsonism and akathisia side effects of antipsychotic treatments.
Synonyms:exact_synonym: (3-endo)-3-(diphenylmethoxy)-8-methyl-8-azabicyclo[3.2.1]octane methanesulfonate
 related_synonym: (3-endo)-3-(diphenylmethoxy)-8-methyl-8-azoniabicyclo[3.2.1]octane methanesulfonate;   3-diphenylmethoxytropane mesylate;   3-diphenylmethoxytropane methanesulfonate;   3alpha-(diphenylmethoxy)-1alphaH,5alphaH-tropane mesylate;   3alpha-(diphenylmethoxy)-1alphaH,5alphaH-tropane methanesulfonate;   3alpha-(diphenylmethoxy)tropane mesylate;   3alpha-(diphenylmethoxy)tropane methanesulfonate;   3endo-benzhydryloxytropane mesylate;   3endo-benzhydryloxytropane methanesulphonate;   Formula=C22H29NO4S;   InChI=1S/C21H25NO.CH4O3S/c1-22-18-12-13-19(22)15-20(14-18)23-21(16-8-4-2-5-9-16)17-10-6-3-7-11-17;1-5(2,3)4/h2-11,18-21H,12-15H2,1H3;1H3,(H,2,3,4)/t18-,19+,20+;;   InChIKey=CPFJLLXFNPCTDW-BWSPSPBFSA-N;   SMILES=CS([O-])(=O)=O.[H][C@]1(C[C@]2([H])CC[C@]([H])(C1)[NH+]2C)OC(c1ccccc1)c1ccccc1;   benzatropine methanesulfonate;   benztropine mesilate;   benztropine mesylate;   benztropine methanesulfonate;   tropine benzohydryl ether mesylate;   tropine benzohydryl ether methanesulphonate
 xref: Beilstein:3826475;   CAS:132-17-2;   DrugBank:DB00245;   KEGG:D00778;   Patent:US2595405


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Term Annotations click to browse term
  CHEBI ontology 22178
    role 22194
      biological role 22162
        antimicrobial agent 19546
          antiviral agent 11398
            anticoronaviral agent 9757
              benzatropine mesylate 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
                    p-block element atom 22104
                      chalcogen 21431
                        oxygen atom 21437
                          oxygen molecular entity 21409
                            hydroxides 20789
                              oxoacid 20101
                                chalcogen oxoacid 14366
                                  sulfur oxoacid 14151
                                    sulfonic acid 11992
                                      sulfo group 10345
                                        organosulfonic acid 10345
                                          alkanesulfonic acid 4036
                                            methanesulfonic acid 4025
                                              methanesulfonates 4022
                                                methanesulfonate salt 2
                                                  benzatropine mesylate 0
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