The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

esmolol hydrochloride
Synonyms

methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride

4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester HCl

4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester hydrochloride

(+-)-methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride

C16H26ClNO4

(+-)-esmolol hydrochloride

esmolol HCl

methyl 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoate hydrochloride

2-hydroxy-3-[4-(3-methoxy-3-oxopropyl)phenoxy]-N-(propan-2-yl)propan-1-aminium chloride

ID

http://purl.obolibrary.org/obo/CHEBI_4857

Definition

The hydrochloride salt of esmolol. A cardioselective and short-acting beta1 receptor blocker with rapid onset but lacking intrinsic sympathomimetic and membrane-stabilising properties, it is used in the management of supraventricular arrhythmias, and for the control of hypertension and tachycardia during surgery.

has role

http://purl.obolibrary.org/obo/CHEBI_38070

http://purl.obolibrary.org/obo/CHEBI_35530

InChI

InChI=1S/C16H25NO4.ClH/c1-12(2)17-10-14(18)11-21-15-7-4-13(5-8-15)6-9-16(19)20-3;/h4-5,7-8,12,14,17-18H,6,9-11H2,1-3H3;1H

InChIKey

InChIKey=GEKNCWBANDDJJL-UHFFFAOYSA-N

label

esmolol hydrochloride

prefixIRI

obo2:CHEBI_4857

prefLabel

esmolol hydrochloride

SMILES

[Cl-].COC(=O)CCc1ccc(OCC(O)C[NH2+]C(C)C)cc1

Synonym

methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride

4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester HCl

4-(2-hydroxy-3-((1-methylethyl)amino)propoxy)benzenepropanoic acid methyl ester hydrochloride

(+-)-methyl p-(2-hydroxy-3-(isopropylamino)propoxy)hydrocinnamate hydrochloride

C16H26ClNO4

(+-)-esmolol hydrochloride

esmolol HCl

methyl 3-{4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}propanoate hydrochloride

2-hydroxy-3-[4-(3-methoxy-3-oxopropyl)phenoxy]-N-(propan-2-yl)propan-1-aminium chloride

xref

CASRN:81161-17-3

CiteXplore:1642945

Beilstein:5185568

ChEMBL:775066

DrugBank:DB00187

KEGG DRUG:D00644

subClassOf

http://purl.obolibrary.org/obo/dinto_000055

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