alverine (CHEBI:518413)

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ChEBI Name	alverine

ChEBI ID	CHEBI:518413

Definition	A tertiary amine having one ethyl and two 3-phenylprop-1-yl groups attached to the nitrogen. An antispasmodic that acts directly on intestinal and uterine smooth muscle, it is used (particularly as the citrate salt) in the treatment of irritable bowel syndrome.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C20H27N

Net Charge

Average Mass

281.43510

Monoisotopic Mass

281.21435

InChI

InChI=1S/C20H27N/c1-2-21(17-9-15-19-11-5-3-6-12-19)18-10-16-20-13-7-4-8-14-20/h3-8,11-14H,2,9-10,15-18H2,1H3

InChIKey

ZPFXAOWNKLFJDN-UHFFFAOYSA-N

SMILES

CCN(CCCc1ccccc1)CCCc1ccccc1

Roles Classification
Chemical Role(s):	Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound )

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.

ChEBI Ontology
Outgoing	alverine (CHEBI:518413) has role antispasmodic drug (CHEBI:53784) alverine (CHEBI:518413) is a tertiary amine (CHEBI:32876) alverine (CHEBI:518413) is conjugate base of alverine(1+) (CHEBI:64320)

Incoming	alverine(1+) (CHEBI:64320) is conjugate acid of alverine (CHEBI:518413)

IUPAC Name

N-ethyl-3-phenyl-N-(3-phenylpropyl)propan-1-amine

Synonyms	Sources
Bis(gamma-phenylpropyl)ethylamine	DrugBank
Di(phenylpropyl)ethylamine	DrugBank
N,N-Bis(3-phenylpropyl)ethylamine	ChemIDplus
N-Ethyl-3,3'-diphenyldipropylamine	DrugBank
N-Ethyl-3-phenyl-N-(3-phenylpropyl)-1-propanamine	NIST Chemistry WebBook
N-Ethyl-N-(3-phenylpropyl)benzenepropanamine	DrugBank
Phenopropamine	DrugBank
Phenpropamine	DrugBank

Last Modified

22 February 2017