CHEBI:9124 - sertraline hydrochloride

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ChEBI Name sertraline hydrochloride
ChEBI ID CHEBI:9124
Definition A hydrochloride resulting from the reaction of equimolar amounts of sertraline and hydrogen chloride. A selective serotonin-reuptake inhibitor (SSRI), it is administered orally as an antidepressant for the treatment of depression, obsessive-compulsive disorder, panic disorder and post-traumatic stress disorder.
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Formula C17H18Cl3N
Net Charge 0
Average Mass 342.69100
Monoisotopic Mass 341.050
InChI InChI=1S/C17H17Cl2N.ClH/c1-20-17-9-7-12(13-4-2-3-5-14(13)17)11-6-8-15(18)16(19)10-11;/h2-6,8,10,12,17,20H,7,9H2,1H3;1H/t12-,17-;/m0./s1
InChIKey BLFQGGGGFNSJKA-XHXSRVRCSA-N
SMILES Cl.[H][C@]1(CC[C@H](NC)c2ccccc12)c1ccc(Cl)c(Cl)c1
Roles Classification
Biological Role(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.
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.
antidepressant
Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing sertraline hydrochloride (CHEBI:9124) has part sertraline(1+) (CHEBI:64214)
sertraline hydrochloride (CHEBI:9124) has role antidepressant (CHEBI:35469)
sertraline hydrochloride (CHEBI:9124) has role serotonin uptake inhibitor (CHEBI:50949)
sertraline hydrochloride (CHEBI:9124) is a hydrochloride (CHEBI:36807)
IUPAC Name
(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
Synonyms Sources
(+)-cis-(1S,4S)-1-methylamino-4-(3,4-dichlorophenyl)tetralin hydrochloride ChEBI
(+)-sertraline hydrochloride ChEBI
(1S,4S)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-aminium chloride IUPAC
(1S-cis)-4-(3,4-dichlorophenyl)-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride ChEBI
sertraline HCl ChemIDplus
Brand Names Sources
Lustral ChEBI
Zoloft KEGG DRUG
Manual Xrefs Databases
D00825 KEGG DRUG
DB01104 DrugBank
HMDB0005010 HMDB
Sertraline Wikipedia
US2008161412 Patent
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Registry Numbers Types Sources
5783715 Reaxys Registry Number Reaxys
79559-97-0 CAS Registry Number KEGG DRUG
79559-97-0 CAS Registry Number ChemIDplus
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Last Modified
19 March 2012