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CHEBI:77779 - tetrindole mesylate

ChEBI IDCHEBI:77779
ChEBI Nametetrindole mesylate
Stars
DefinitionA racemate composed of equimolar amounts of (R)- and (S)-tetrindole mesylate.
Last Modified20 March 2014
SubmitterSteve
DownloadsMolfile
FormulaC20H26N2.CH4O3S
Net Charge0
Average Mass390.549
Monoisotopic Mass390.19771
SMILESCS(=O)(=O)O.c1cc2c(cc1C1CCCCC1)c1c3n2CCNC3CCC1
InChIInChI=1S/C20H26N2.CH4O3S/c1-2-5-14(6-3-1)15-9-10-19-17(13-15)16-7-4-8-18-20(16)22(19)12-11-21-18;1-5(2,3)4/h9-10,13-14,18,21H,1-8,11-12H2;1H3,(H,2,3,4)
InChIKeyCWPNPYVNPOAMHY-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
serotonergic agonist  An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
EC 1.4.3.4 (monoamine oxidase) inhibitor  An EC 1.4.3.* (oxidoreductase acting on donor CH-NH2 group, oxygen as acceptor) inhibitor that interferes with the action of monoamine oxidase (EC 1.4.3.4).
Applications:
serotonergic agonist  An agent that has an affinity for serotonin receptors and is able to mimic the effects of serotonin by stimulating the physiologic activity at the cell receptors. Serotonin agonists are used as antidepressants, anxiolytics, and in the treatment of migraine disorders.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
ChEBI Ontology
Outgoing Relation(s)
tetrindole mesylate (CHEBI:77779) has part (R)-tetrindole mesylate (CHEBI:77782)
tetrindole mesylate (CHEBI:77779) has part (S)-tetrindole mesylate (CHEBI:77785)
tetrindole mesylate (CHEBI:77779) has role antidepressant (CHEBI:35469)
tetrindole mesylate (CHEBI:77779) has role EC 1.4.3.4 (monoamine oxidase) inhibitor (CHEBI:38623)
tetrindole mesylate (CHEBI:77779) has role serotonergic agonist (CHEBI:35941)
tetrindole mesylate (CHEBI:77779) is a racemate (CHEBI:60911)
IUPAC Names 
rac-8-cyclohexyl-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazole methanesulfonate
rac-8-cyclohexyl-2,3,3a,4,5,6-hexahydro-1H-pyrazino[3,2,1-jk]carbazol-3-ium methanesulfonate
Synonym  Source
tetrindole methanesulfonateChEBI
Manual XrefsDatabases
TetrindoleWikipedia
Registry NumbersSources
Reaxys:7327421Reaxys