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CHEBI:59782 - diphemanil methylsulfate

Default Structure
ChEBI IDCHEBI:59782
ChEBI Namediphemanil methylsulfate
Stars
DefinitionThe alkene resulting from the formal Wittig olefination of benzophenone and 1,1-dimethyl-4-bromopiperidinium methylsulfate. A quaternary ammonium anticholinergic, it binds muscarinic acetycholine receptors and thereby decreases secretory excretion of stomach acids, saliva and sweat, It is used topically in the treatment of hyperhidorsis (excessive sweating).
Last Modified19 July 2010
SubmitterGareth Owen
DownloadsMolfile
FormulaC20H24N.CH3O4S
Net Charge0
Average Mass389.517
Monoisotopic Mass389.16608
SMILESCOS(=O)(=O)[O-].C[N+]1(C)CCC(=C(c2ccccc2)c2ccccc2)CC1
InChIInChI=1S/C20H24N.CH4O4S/c1-21(2)15-13-19(14-16-21)20(17-9-5-3-6-10-17)18-11-7-4-8-12-18;1-5-6(2,3)4/h3-12H,13-16H2,1-2H3;1H3,(H,2,3,4)/q+1;/p-1
InChIKeyBREMLQBSKCSNNH-UHFFFAOYSA-M
Wikipedia
Roles Classification
Biological Roles:
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
parasympatholytic  Any cholinergic antagonist that inhibits the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the muscarinic antagonists.
Applications:
bronchodilator agent  An agent that causes an increase in the expansion of a bronchus or bronchial tubes.
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
parasympatholytic  Any cholinergic antagonist that inhibits the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the muscarinic antagonists.
ChEBI Ontology
Outgoing Relation(s)
diphemanil methylsulfate (CHEBI:59782) has role bronchodilator agent (CHEBI:35523)
diphemanil methylsulfate (CHEBI:59782) has role muscarinic antagonist (CHEBI:48876)
diphemanil methylsulfate (CHEBI:59782) has role parasympatholytic (CHEBI:50370)
diphemanil methylsulfate (CHEBI:59782) is a piperidines (CHEBI:26151)
diphemanil methylsulfate (CHEBI:59782) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Name 
4-(diphenylmethylidene)-1,1-dimethylpiperidinium methyl sulfate
INNs  Source
diphemanili metilsulfasChemIDplus
diphemanil methylsulfateChemIDplus
metilsulfate de diphemanilChemIDplus
metilsulfato de difemaniloChemIDplus
Synonyms  Source
4-(diphenylmethylene)-1,1-dimethylpiperidinium methyl sulfateChemIDplus
diphemanil methosulfateChemIDplus
diphemanil metilsulfateChEBI
N,N-dimethyl-4-piperidylidene-1,1-diphenylmethane methylsulfateChEBI
p-(α-phenylbenzylidene)-1,1-dimethylpiperidinium methyl sulfateChemIDplus
Manual XrefsDatabases
D06878KEGG DRUG
DB00729DrugBank
DiphemanilWikipedia
US2739968Patent
Registry NumbersSources
Beilstein:3842254Beilstein
CAS:62-97-5KEGG DRUG
CAS:62-97-5ChemIDplus