CHEBI:31327 - butropium bromide

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ChEBI Name butropium bromide
ChEBI ID CHEBI:31327
Definition An organic bromide salt of butropium. It is a drug which suppresses spasm of smooth muscles of internal organs, inhibits gastric acid secretion and relieves abdominal pain. It is used in the treatment of spasmodic pains associated with gastritis, gastric ulcers and cholelithiasis.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C28H38NO4.Br
Net Charge 0
Average Mass 532.519
Monoisotopic Mass 531.19842
InChI InChI=1S/C28H38NO4.BrH/c1-3-4-16-32-25-14-10-21(11-15-25)19-29(2)23-12-13-24(29)18-26(17-23)33-28(31)27(20-30)22-8-6-5-7-9-22;/h5-11,14-15,23-24,26-27,30H,3-4,12-13,16-20H2,1-2H3;1H/q+1;/p-1/t23-,24+,26+,27-,29?;/m1./s1
InChIKey JABDOYKGZCPHPX-XSCYYCMVSA-M
SMILES [C@@H]1(C[C@H]2CC[C@@H](C1)[N+]2(C)CC3=CC=C(C=C3)OCCCC)OC([C@@H](C=4C=CC=CC4)CO)=O.[Br-]
Roles Classification
Biological Role(s): muscarinic antagonist
A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
Application(s): antispasmodic drug
A drug that suppresses spasms. These are usually caused by smooth muscle contraction, especially in tubular organs. The effect is to prevent spasms of the stomach, intestine or urinary bladder.
muscarinic antagonist
A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing butropium bromide (CHEBI:31327) has part butropium (CHEBI:145697)
butropium bromide (CHEBI:31327) has role antispasmodic drug (CHEBI:53784)
butropium bromide (CHEBI:31327) has role muscarinic antagonist (CHEBI:48876)
butropium bromide (CHEBI:31327) is a organic bromide salt (CHEBI:48369)
butropium bromide (CHEBI:31327) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Name
(3-endo)-8-(4-butoxybenzyl)-3-{[(2S)-3-hydroxy-2-phenylpropanoyl]oxy}-8-methyl-8-azoniabicyclo[3.2.1]octane bromide
INNs Sources
bromure de butropium WHO MedNet
bromuro de butropio WHO MedNet
butropii bromidum WHO MedNet
butropium bromide WHO MedNet
Synonyms Sources
(1R,3r,5S)-8-[(4-butoxyphenyl)methyl]-3-{[(2S)-3-hydroxy-2-phenylpropanoyl]oxy}-8-methyl-8-azabicyclo[3.2.1]octan-8-ium bromide IUPAC
butropium Br ChEBI
p-butoxybenzyl hyoscyaminium bromide ChemIDplus
Brand Name Source
Coliopan KEGG DRUG
Manual Xrefs Databases
456 DrugCentral
D01491 KEGG DRUG
View more database links
Registry Number Type Source
29025-14-7 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
3449985 PubMed citation Europe PMC
3478945 PubMed citation Europe PMC
4084348 PubMed citation Europe PMC
4807878 PubMed citation Europe PMC
7182948 PubMed citation Europe PMC
7431672 PubMed citation Europe PMC
Last Modified
17 December 2019