sibutramine (CHEBI:9137)

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ChEBI Name	sibutramine

ChEBI ID	CHEBI:9137

Definition	A tertiary amino compound that is N,N,3-trimethylbutan-1-amine substituted by a (4-chlorophenyl)cyclobutyl group at position 1.

Stars	This entity has been manually annotated by a third party.

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Formula

C17H26ClN

Net Charge

Average Mass

279.84800

InChI

InChI=1S/C17H26ClN/c1-13(2)12-16(19(3)4)17(10-5-11-17)14-6-8-15(18)9-7-14/h6-9,13,16H,5,10-12H2,1-4H3

InChIKey

UNAANXDKBXWMLN-UHFFFAOYSA-N

SMILES

CC(C)CC(N(C)C)C1(CCC1)c1ccc(Cl)cc1

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

Biological Role(s):	anti-obesity agent Any substance which is used to reduce or control weight. serotonin uptake inhibitor A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.

Application(s):	serotonin uptake inhibitor A compound that specifically inhibits the reuptake of serotonin in the brain. This increases the serotonin concentration in the synaptic cleft which then activates serotonin receptors to a greater extent.

ChEBI Ontology
Outgoing	sibutramine (CHEBI:9137) has role anti-obesity agent (CHEBI:74518) sibutramine (CHEBI:9137) has role serotonin uptake inhibitor (CHEBI:50949) sibutramine (CHEBI:9137) is a organochlorine compound (CHEBI:36683) sibutramine (CHEBI:9137) is a tertiary amino compound (CHEBI:50996)

IUPAC Name

1-[1-(4-chlorophenyl)cyclobutyl]-N,N,3-trimethylbutan-1-amine

Synonyms	Sources
(+/-)-Sibutramine	DrugCentral
BTS 54524	DrugCentral
didemethyl sibutramine HCl	DrugCentral
didemethyl sibutramine hydrochloride	DrugCentral
didesmethylsibutramine	DrugCentral
racemic sibutramine	DrugCentral
Sibutramine	KEGG COMPOUND
sibutramine HCl	DrugCentral
sibutramine hydrochloride	DrugCentral
sibutramine hydrochloride hydrate	DrugCentral

Last Modified

22 February 2017