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CHEBI:65344 - aclidinium bromide

Default Structure
ChEBI IDCHEBI:65344
ChEBI Nameaclidinium bromide
Stars
DefinitionA quaternary ammonium salt that is the bromide salt of aclidinium. A muscarinic acetylcholine M3 receptor antagonist, for the long-term maintenance treatment of bronchospasm associated with chronic obstructive pulmonary disease (COPD).
Last Modified27 July 2012
SubmitterSteve
DownloadsMolfile
FormulaBr.C26H30NO4S2
Net Charge0
Average Mass564.567
Monoisotopic Mass563.07996
SMILESO=C(O[C@H]1C[N+]2(CCCOc3ccccc3)CCC1CC2)C(O)(c1cccs1)c1cccs1.[Br-]
InChIInChI=1S/C26H30NO4S2.BrH/c28-25(26(29,23-9-4-17-32-23)24-10-5-18-33-24)31-22-19-27(14-11-20(22)12-15-27)13-6-16-30-21-7-2-1-3-8-21;/h1-5,7-10,17-18,20,22,29H,6,11-16,19H2;1H/q+1;/p-1/t20?,22-,27?;/m0./s1
InChIKeyXLAKJQPTOJHYDR-QTQXQZBYSA-M
Wikipedia
Roles Classification
Biological Role:
muscarinic antagonist  A drug that binds to but does not activate muscarinic cholinergic receptors, thereby blocking the actions of endogenous acetylcholine or exogenous agonists.
Applications:
bronchodilator agent  An agent that causes an increase in the expansion of a bronchus or bronchial tubes.
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.
ChEBI Ontology
Outgoing Relation(s)
aclidinium bromide (CHEBI:65344) has part aclidinium (CHEBI:65346)
aclidinium bromide (CHEBI:65344) has role antispasmodic drug (CHEBI:53784)
aclidinium bromide (CHEBI:65344) has role bronchodilator agent (CHEBI:35523)
aclidinium bromide (CHEBI:65344) has role muscarinic antagonist (CHEBI:48876)
aclidinium bromide (CHEBI:65344) is a organic bromide salt (CHEBI:48369)
aclidinium bromide (CHEBI:65344) is a quaternary ammonium salt (CHEBI:35273)
IUPAC Name 
(3R)-3-[2-hydroxy(di-2-thienyl)acetoxy]-1-(3-phenoxypropyl)-1-azoniabicyclo[2.2.2]octane bromide
INNs  Source
aclidinium bromideKEGG DRUG
bromure d'aclidiniumWHO MedNet
bromuro de aclidinioWHO MedNet
Synonyms  Source
14115700ChEMBL
GenuairChEMBL
LAS 34273ChemIDplus
LAS-34273ChEMBL
LAS34273ChEMBL
LAS 34273 MICRONIZEDChEMBL
Brand Names  Source
Aclidinium bromide component of duaklir pressairChEMBL
Bretaris genuairChEMBL
EkliraChEMBL
Eklira genuairChEMBL
Tudorza PressairChemIDplus
Manual XrefsDatabases
Aclidinium_bromideWikipedia
D08837KEGG DRUG
US2005267078Patent
Registry NumbersSources
Reaxys:11340576Reaxys
CAS:320345-99-1ChemIDplus
Citations