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Chemical Entities of Biological Interest Ontology
Last uploaded:
December 1, 2024
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| Preferred Name | vortioxetine hydrobromide | |
| Synonyms |
Brintellix 1-(2-((2,4-Dimethylphenyl)sulfanyl)phenyl)piperazine monohydrobromide vortioxetine monohydrobromide 1-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine hydrobromide 4-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazin-1-ium bromide |
|
| Definitions |
A hydrobromide obtained by combining vortioxetine with one molar equivalent of hydrobromic acid. Used for treatment of major depressive disorder. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_76015 |
|
| charge |
0
|
|
| database_cross_reference |
Wikipedia:Vortioxetine Patent:WO2007144005 KEGG:D10185 CAS:960203-27-4 Reaxys:15607074
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|
| definition |
A hydrobromide obtained by combining vortioxetine with one molar equivalent of hydrobromic acid. Used for treatment of major depressive disorder.
|
|
| formula |
C18H23BrN2S
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|
| has part | ||
| has role |
http://purl.obolibrary.org/obo/CHEBI_35474 http://purl.obolibrary.org/obo/CHEBI_35941 |
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| has_exact_synonym |
1-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine hydrobromide 4-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazin-1-ium bromide
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|
| has_obo_namespace |
chebi_ontology
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|
| has_related_synonym |
Brintellix 1-(2-((2,4-Dimethylphenyl)sulfanyl)phenyl)piperazine monohydrobromide vortioxetine monohydrobromide
|
|
| id |
CHEBI:76015
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|
| in_subset | ||
| inchi |
InChI=1S/C18H22N2S.BrH/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20;/h3-8,13,19H,9-12H2,1-2H3;1H
|
|
| inchikey |
VNGRUFUIHGGOOM-UHFFFAOYSA-N
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|
| label |
vortioxetine hydrobromide
|
|
| mass |
379.35800
|
|
| monoisotopicmass |
378.07653
|
|
| notation |
CHEBI:76015
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|
| prefLabel |
vortioxetine hydrobromide
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|
| smiles |
Br.Cc1ccc(Sc2ccccc2N2CCNCC2)c(C)c1
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| treeView | ||
| subClassOf |
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