The Drug Ontology

Last uploaded: March 3, 2024
Preferred Name

bethanechol

Synonyms

Bethanechol

2-(carbamoyloxy)-N,N,N-trimethylpropan-1-aminium

amidopropyldimethylbetaine

carbamyl-beta-methylcholine

(2-hydroxypropyl)trimethylammonium carbamate

carbamoyl-beta-methylcholine

2-carbamoyloxypropyl-trimethylazanium

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

charge

+1

database_cross_reference

KEGG:C06850

DrugBank:DB01019

PMID:17889543

Beilstein:1773706

Drug_Central:358

LINCS:LSM-5196

CAS:674-38-4

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.

formula

C7H17N2O2

has role

http://purl.obolibrary.org/obo/CHEBI_38325

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

http://purl.obolibrary.org/obo/chebi#3_STAR

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

prefLabel

bethanechol

smiles

CC(C[N+](C)(C)C)OC(N)=O

subClassOf

http://purl.obolibrary.org/obo/CHEBI_23003

http://purl.obolibrary.org/obo/CHEBI_35267

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http://purl.obolibrary.org/obo/CHEBI_3084 PDRO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3084 FIDEO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3084 DINTO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3084 BERO SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3084 BIOMODELS SAME_URI
http://purl.obolibrary.org/obo/CHEBI_3084 CHEBI SAME_URI
http://stirdf.jst.go.jp/id/200907021703241341 IOBC LOOM
http://www.drugbank.ca/drugs/DB01019 FTC LOOM
http://purl.bioontology.org/ontology/RCD/x01DL RCD LOOM
http://purl.obolibrary.org/obo/MESH_D018723 BERO LOOM
http://purl.obolibrary.org/obo/NCIT_C76039 BERO LOOM
http://purl.jp/bio/4/id/200906016838604110 IOBC LOOM
http://purl.bioontology.org/ontology/NDFRT/N0000147727 NDFRT LOOM
http://purl.bioontology.org/ontology/LNC/MTHU006820 LOINC LOOM
http://purl.bioontology.org/ontology/SNOMEDCT/372698003 SNOMEDCT LOOM
http://purl.bioontology.org/ontology/VANDF/4019634 VANDF LOOM
http://purl.obolibrary.org/obo/OMIT_0018885 OMIT LOOM
http://purl.bioontology.org/ontology/ATC/N07AB02 ATC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#13587 OCHV LOOM
http://purl.bioontology.org/ontology/LNC/LP18907-3 LOINC LOOM
http://sbmi.uth.tmc.edu/ontology/ochv#C0053526 OCHV LOOM
http://purl.bioontology.org/ontology/SNMI/C-67120 SNMI LOOM
http://purl.bioontology.org/ontology/MESH/D018723 MESH LOOM
http://ncicb.nci.nih.gov/xml/owl/EVS/Thesaurus.owl#C76039 NCIT LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 PDRO LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 FIDEO LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 DINTO LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 BERO LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 BIOMODELS LOOM
http://purl.obolibrary.org/obo/CHEBI_3084 CHEBI LOOM
http://purl.bioontology.org/ontology/NDDF/004683 NDDF LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.675.276.148.100 RH-MESH LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D018723 RH-MESH LOOM
https://go.drugbank.com/drugs/DB01019 MDM LOOM
http://purl.bioontology.org/ontology/RXNORM/19257 RXNORM LOOM
http://www.co-ode.org/ontologies/galen#Bethanechol GALEN LOOM
http://www.phoc.org.cn/pmo/class/PMO_00016050 PMAPP-PMO LOOM
http://phenomebrowser.net/ontologies/mesh/mesh.owl#D02.092.877.883.088.100 RH-MESH LOOM