loading...| Preferred Name | bethanechol | |
| Synonyms |
amidopropyldimethylbetaine carbamyl-beta-methylcholine (2-hydroxypropyl)trimethylammonium carbamate 2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium carbamoyl-beta-methylcholine 2-carbamoyloxypropyl-trimethylazanium Bethanechol |
|
| Definitions |
The carbamic acid ester of 2-methylcholine. A slowly hydrolysed muscarinic agonist with no nicotinic effects, it is used as its chloride salt to increase smooth muscle tone, as in the gastrointestinal tract following abdominal surgery, treatment of gastro-oesophageal reflux disease, and as an alternative to catheterisation in the treatment of non-obstructive urinary retention. |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_3084 |
|
| alternative term |
amidopropyldimethylbetaine carbamyl-beta-methylcholine (2-hydroxypropyl)trimethylammonium carbamate 2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium carbamoyl-beta-methylcholine 2-carbamoyloxypropyl-trimethylazanium Bethanechol |
|
| bearer_of | ||
| charge |
+1 |
|
| database_cross_reference |
KEGG:C06850 DrugBank:DB01019 PMID:17889543 Beilstein:1773706 Drug_Central:358 LINCS:LSM-5196 CAS:674-38-4 |
|
| formula |
C7H17N2O2 |
|
| has role | ||
| has_alternative_id |
CHEBI:506520 |
|
| has_exact_synonym |
Bethanechol 2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium |
|
| has_obo_namespace |
chebi_ontology |
|
| has_related_synonym |
amidopropyldimethylbetaine carbamyl-beta-methylcholine (2-hydroxypropyl)trimethylammonium carbamate 2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium carbamoyl-beta-methylcholine 2-carbamoyloxypropyl-trimethylazanium |
|
| has_RxCUI |
19257 |
|
| id |
CHEBI:3084 |
|
| in_subset | ||
| inchi |
InChI=1S/C7H16N2O2/c1-6(11-7(8)10)5-9(2,3)4/h6H,5H2,1-4H3,(H-,8,10)/p+1 |
|
| inchikey |
NZUPCNDJBJXXRF-UHFFFAOYSA-O |
|
| label |
bethanechol Bethanechol |
|
| mass |
161.22150 |
|
| monoisotopicmass |
161.12845 |
|
| notation |
CHEBI:3084 |
|
| prefixIRI |
CHEBI:3084 |
|
| prefLabel |
bethanechol |
|
| smiles |
CC(C[N+](C)(C)C)OC(N)=O |
|
| textual definition |
The carbamic acid ester of 2-methylcholine. A slowly hydrolysed muscarinic agonist with no nicotinic effects, it is used as its chloride salt to increase smooth muscle tone, as in the gastrointestinal tract following abdominal surgery, treatment of gastro-oesophageal reflux disease, and as an alternative to catheterisation in the treatment of non-obstructive urinary retention. |
|
| subClassOf |