CHEBI:53785 - alverine citrate

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ChEBI Name alverine citrate
ChEBI ID CHEBI:53785
Definition The citrate salt of alverine, resulting from the reaction of equimolar amounts of alvarine and citric acid. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used in the treatment of irritable bowel syndrome.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formulae C20H27N.C6H8O7
C26H35NO7
Net Charge 0
Average Mass 473.55860
Monoisotopic Mass 473.24135
InChI InChI=1S/C20H27N.C6H8O7/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20;7-3(8)1-6(13,5(11)12)2-4(9)10/h3-8,11-14H,2,9-10,15-18H2,1H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)
InChIKey RYHCACJBKCOBTJ-UHFFFAOYSA-N
SMILES OC(=O)CC(O)(CC(O)=O)C(O)=O.CCN(CCCc1ccccc1)CCCc1ccccc1
Roles Classification
Biological Role(s): cholinergic antagonist
Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
Application(s): cholinergic antagonist
Any drug that binds to but does not activate cholinergic receptors, thereby blocking the actions of acetylcholine or cholinergic agonists.
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.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing alverine citrate (CHEBI:53785) has part alverine(1+) (CHEBI:64320)
alverine citrate (CHEBI:53785) has role antispasmodic drug (CHEBI:53784)
alverine citrate (CHEBI:53785) has role cholinergic antagonist (CHEBI:48873)
alverine citrate (CHEBI:53785) is a citrate salt (CHEBI:50744)
alverine citrate (CHEBI:53785) is a organoammonium salt (CHEBI:46850)
IUPAC Name
N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine 2-hydroxypropane-1,2,3-tricarboxylate
Synonym Source
N-Ethyl-3,3'-diphenyldipropylamine citrate ChemIDplus
Manual Xrefs Databases
CN101838205 Patent
D02877 KEGG DRUG
DB01616 DrugBank
View more database links
Registry Numbers Types Sources
3851428 Beilstein Registry Number Beilstein
3851428 Reaxys Registry Number Reaxys
5560-59-8 CAS Registry Number KEGG DRUG
5560-59-8 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
12030962 PubMed citation Europe PMC
15259090 PubMed citation Europe PMC
17934514 PubMed citation Europe PMC
19115153 PubMed citation Europe PMC
19148544 PubMed citation Europe PMC
20003095 PubMed citation Europe PMC
20375645 PubMed citation Europe PMC
20415841 PubMed citation Europe PMC
21698811 PubMed citation Europe PMC
Last Modified
29 March 2012