CHEBI:77570 - tropisetron hydrochloride

ChEBI IDCHEBI:77570
ChEBI Nametropisetron hydrochloride
Stars
DefinitionA hydrochloride obtained by combining equimolar amounts of tropisetron and hydrogen chloride.
Last Modified4 March 2014
SubmitterSteve
DownloadsMolfile
FormulaC17H20N2O2.HCl
Net Charge0
Average Mass320.820
Monoisotopic Mass320.12916
SMILESCl.[H][C@]12CC[C@]([H])(C[C@H](OC(=O)c3cnc4ccccc34)C1)N2C
InChIInChI=1S/C17H20N2O2.ClH/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16;/h2-5,10-13,18H,6-9H2,1H3;1H/t11-,12+,13+;
InChIKeyXIEGSJAEZIGKSA-LUNMCBQDSA-N
Wikipedia
Roles Classification
Biological Roles:
immunomodulator  Biologically active substance whose activity affects or plays a role in the functioning of the immune system.
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
apoptosis inhibitor  Any substance that inhibits the process of apoptosis (programmed cell death) in multi-celled organisms.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
trypanocidal drug  A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
Applications:
anti-inflammatory agent  Any compound that has anti-inflammatory effects.
immunomodulator  Biologically active substance whose activity affects or plays a role in the functioning of the immune system.
antiemetic  A drug used to prevent nausea or vomiting. An antiemetic may act by a wide range of mechanisms: it might affect the medullary control centres (the vomiting centre and the chemoreceptive trigger zone) or affect the peripheral receptors.
neuroprotective agent  Any compound that can be used for the treatment of neurodegenerative disorders.
nicotinic acetylcholine receptor agonist  An agonist that selectively binds to and activates a nicotinic acetylcholine receptor.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
trypanocidal drug  A drug used to treat or prevent infections caused by protozoal organisms belonging to the suborder Trypanosomatida.
ChEBI Ontology
Outgoing Relation(s)
tropisetron hydrochloride (CHEBI:77570) has part tropisetron(1+) (CHEBI:77571)
tropisetron hydrochloride (CHEBI:77570) has role anti-inflammatory agent (CHEBI:67079)
tropisetron hydrochloride (CHEBI:77570) has role antiemetic (CHEBI:50919)
tropisetron hydrochloride (CHEBI:77570) has role apoptosis inhibitor (CHEBI:68494)
tropisetron hydrochloride (CHEBI:77570) has role immunomodulator (CHEBI:50846)
tropisetron hydrochloride (CHEBI:77570) has role neuroprotective agent (CHEBI:63726)
tropisetron hydrochloride (CHEBI:77570) has role nicotinic acetylcholine receptor agonist (CHEBI:47958)
tropisetron hydrochloride (CHEBI:77570) has role serotonergic antagonist (CHEBI:48279)
tropisetron hydrochloride (CHEBI:77570) has role trypanocidal drug (CHEBI:36335)
tropisetron hydrochloride (CHEBI:77570) is a hydrochloride (CHEBI:36807)
IUPAC Names 
(3-endo,8-syn)-3-[(1H-indol-3-ylcarbonyl)oxy]-8-methyl-8-azoniabicyclo[3.2.1]octane chloride
(3-endo)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl 1H-indole-3-carboxylate hydrochloride
Synonyms  Source
Tropisetron HClChemIDplus
Tropisetron monohydrochlorideChemIDplus
Brand Name  Source
NavobanKEGG DRUG
Manual XrefsDatabases
CN101278921Patent
CN101444508Patent
CN1682721Patent
D02041KEGG DRUG
TropisetronWikipedia
Registry NumbersSources
Reaxys:11257467Reaxys
CAS:105826-92-4ChemIDplus
CAS:105826-92-4KEGG DRUG
Citations