CHEBI:9728 - trimethaphan

ChEBI IDCHEBI:9728
ChEBI Nametrimethaphan
Stars
DefinitionA complex heterocyclic sulfonium compound with an imidazolium core, used to treat hypertension.
Last Modified22 February 2017
DownloadsMolfile
FormulaC22H25N2OS
Net Charge+1
Average Mass365.522
Monoisotopic Mass365.16821
SMILESO=C1N(Cc2ccccc2)C2C[S+]3CCCC3C2N1Cc1ccccc1
InChIInChI=1S/C22H25N2OS/c25-22-23(14-17-8-3-1-4-9-17)19-16-26-13-7-12-20(26)21(19)24(22)15-18-10-5-2-6-11-18/h1-6,8-11,19-21H,7,12-16H2/q+1
InChIKeyCHQOEHPMXSHGCL-UHFFFAOYSA-N
Roles Classification
Biological Roles:
nicotinic antagonist  An antagonist at the nicotinic cholinergic receptor.
insulin-sensitizing drug  An agent which overcomes insulin resistance by activation of the peroxisome proliferator activated receptor gamma (PPAR-gamma).
Applications:
nicotinic antagonist  An antagonist at the nicotinic cholinergic receptor.
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
vasodilator agent  A drug used to cause dilation of the blood vessels.
insulin-sensitizing drug  An agent which overcomes insulin resistance by activation of the peroxisome proliferator activated receptor gamma (PPAR-gamma).
anaesthesia adjuvant  Any substance that possesses little anaesthetic effect by itself, but which enhances or potentiates the anaesthetic action of other drugs when given at the same time.
ChEBI Ontology
Outgoing Relation(s)
trimethaphan (CHEBI:9728) has role anaesthesia adjuvant (CHEBI:60807)
trimethaphan (CHEBI:9728) has role antihypertensive agent (CHEBI:35674)
trimethaphan (CHEBI:9728) has role insulin-sensitizing drug (CHEBI:50864)
trimethaphan (CHEBI:9728) has role nicotinic antagonist (CHEBI:48878)
trimethaphan (CHEBI:9728) has role vasodilator agent (CHEBI:35620)
trimethaphan (CHEBI:9728) is a organic molecular entity (CHEBI:50860)
trimethaphan (CHEBI:9728) is a racemate (CHEBI:60911)
trimethaphan (CHEBI:9728) is a sulfonium compound (CHEBI:26830)
Incoming Relation(s)
trimethaphan camsylate (CHEBI:9729) has part trimethaphan (CHEBI:9728)
IUPAC Name 
1,3-dibenzyl-2-oxodecahydrothieno[1',2':1,2]thieno[3,4-d]imidazol-5-ium
Synonyms  Source
TrimetaphanChemIDplus
TrimetaphanumChemIDplus
TrimethaphanKEGG COMPOUND
Trimethaphan cationChEMBL
Trimethaphan ionChEMBL
Manual XrefsDatabases
2752DrugCentral
C07174KEGG COMPOUND
DB01116DrugBank
Registry NumbersSources
CAS:7187-66-8KEGG COMPOUND
CAS:7187-66-8ChemIDplus