CHEBI:253342 - alosetron

ChEBI IDCHEBI:253342
ChEBI Namealosetron
Stars
DefinitionA pyrido[4,3-b]indole compound having a 5-methyl-1H-imidazol-4-ylmethyl group at the 2-position.
Last Modified22 February 2017
DownloadsMolfile
FormulaC17H18N4O
Net Charge0
Average Mass294.358
Monoisotopic Mass294.14806
SMILESCc1ncnc1CN1CCc2c(c3ccccc3n2C)C1=O
InChIInChI=1S/C17H18N4O/c1-11-13(19-10-18-11)9-21-8-7-15-16(17(21)22)12-5-3-4-6-14(12)20(15)2/h3-6,10H,7-9H2,1-2H3,(H,18,19)
InChIKeyJSWZEAMFRNKZNL-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Role:
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
Applications:
gastrointestinal drug  A drug used for its effects on the gastrointestinal system, e.g. controlling gastric acidity, regulating gastrointestinal motility and water flow, and improving digestion.
serotonergic antagonist  Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or serotonergic agonists.
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.
ChEBI Ontology
Outgoing Relation(s)
alosetron (CHEBI:253342) has role antiemetic (CHEBI:50919)
alosetron (CHEBI:253342) has role gastrointestinal drug (CHEBI:55324)
alosetron (CHEBI:253342) has role serotonergic antagonist (CHEBI:48279)
alosetron (CHEBI:253342) is a imidazoles (CHEBI:24780)
alosetron (CHEBI:253342) is a pyridoindole (CHEBI:48888)
Incoming Relation(s)
alosetron hydrochloride (CHEBI:53783) has part alosetron (CHEBI:253342)
IUPAC Name 
5-methyl-2-[(5-methyl-1H-imidazol-4-yl)methyl]-2,3,4,5-tetrahydro-1H-pyrido[4,3-b]indol-1-one
INN  Source
alosetronKEGG DRUG
Synonym  Source
2,3,4,5-Tetrahydro-5-methyl-2-((5-methyl-1H-imidazol-4-yl)methyl)-1H-pyrido(4,3-b)indol-1-oneChemIDplus
Manual XrefsDatabases
D07129KEGG DRUG
DB00969DrugBank
EP306323Patent
US5360800Patent
AlosetronWikipedia
LSM-5576LINCS
129DrugCentral
Registry NumbersSources
Beilstein:7140558Beilstein
CAS:122852-42-0KEGG DRUG
CAS:122852-42-0DrugBank
CAS:122852-42-0ChemIDplus