The Drug-Drug Interactions Ontology

Last uploaded: February 11, 2016
Preferred Name

acebutolol hydrochloride

Synonyms

C18H28N2O4.HCl

Prent

N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide hydrochloride

dl-1-(2-acetyl-4-butyramidophenoxy)-2-hydroxy-3-isopropylaminopropane hydrochloride

Sectral

(+-)-3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide monohydrochloride

Neptal

3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide hydrochloride

Acebutolol hydrochloride

ID

http://purl.obolibrary.org/obo/CHEBI_2380

Definition

The hydrochloride salt of acebutolol, prepared using equimolar amounts of acebutolol and hydrogen chloride.

has role

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

http://purl.obolibrary.org/obo/CHEBI_35524

http://purl.obolibrary.org/obo/CHEBI_35674

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

InChI

InChI=1S/C18H28N2O4.ClH/c1-5-6-18(23)20-14-7-8-17(16(9-14)13(4)21)24-11-15(22)10-19-12(2)3;/h7-9,12,15,19,22H,5-6,10-11H2,1-4H3,(H,20,23);1H

InChIKey

InChIKey=KTUFKADDDORSSI-UHFFFAOYSA-N

label

acebutolol hydrochloride

prefixIRI

obo2:CHEBI_2380

prefLabel

acebutolol hydrochloride

SMILES

Cl[H].CCCC(=O)Nc1ccc(OCC(O)CNC(C)C)c(c1)C(C)=O

Synonym

C18H28N2O4.HCl

Prent

N-{3-acetyl-4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl}butanamide hydrochloride

dl-1-(2-acetyl-4-butyramidophenoxy)-2-hydroxy-3-isopropylaminopropane hydrochloride

Sectral

(+-)-3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide monohydrochloride

Neptal

3'-acetyl-4'-(2-hydroxy-3-(isopropylamino)propoxy)butyranilide hydrochloride

Acebutolol hydrochloride

xref

KEGG DRUG:D00597

Beilstein:6080568

Gmelin:2181029

KEGG COMPOUND:C07677

ChEMBL:774764

DrugBank:DB01193

CASRN:34381-68-5

subClassOf

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

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