CHEBI:3012 - benazepril hydrochloride

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ChEBI Name benazepril hydrochloride
ChEBI ID CHEBI:3012
Definition A hydrochloride salt resulting from the reaction of benazepril with 1 mol eq. of hydrogen chloride. It is used as a prodrug for angiotensin-converting enzyme inhibitor benazeprilat in the treatment of hypertension and heart failure.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C24H29ClN2O5
Net Charge 0
Average Mass 460.951
Monoisotopic Mass 460.17650
InChI InChI=1S/C24H28N2O5.ClH/c1-2-31-24(30)20(14-12-17-8-4-3-5-9-17)25-19-15-13-18-10-6-7-11-21(18)26(23(19)29)16-22(27)28;/h3-11,19-20,25H,2,12-16H2,1H3,(H,27,28);1H/t19-,20-;/m0./s1
InChIKey VPSRQEHTHIMDQM-FKLPMGAJSA-N
SMILES C1C=2C(N(C([C@](C1)(N[C@H](C(=O)OCC)CCC3=CC=CC=C3)[H])=O)CC(O)=O)=CC=CC2.Cl
Roles Classification
Biological Role(s): EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1).
Application(s): EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
An EC 3.4.15.* (peptidyl-dipeptidase) inhibitor that interferes with the action of peptidyl-dipeptidase A (EC 3.4.15.1).
View more via ChEBI Ontology
ChEBI Ontology
Outgoing benazepril hydrochloride (CHEBI:3012) has part benazepril(1+) (CHEBI:88201)
benazepril hydrochloride (CHEBI:3012) has role EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (CHEBI:35457)
benazepril hydrochloride (CHEBI:3012) is a hydrochloride (CHEBI:36807)
IUPAC Name
[(3S)-3-{[(2S)-1-ethoxy-1-oxo-4-phenylbutan-2-yl]amino}-2-oxo-2,3,4,5-tetrahydro-1H-1-benzazepin-1-yl]acetic acid hydrochloride
Synonyms Sources
benazepril HCl ChemIDplus
benazepril monohydrochloride ChEBI
Brand Names Sources
Briem ChemIDplus
Cibace ChemIDplus
Cibacen ChemIDplus
Cibacene ChemIDplus
Labopol ChemIDplus
Lotensin KEGG DRUG
Tensanil ChemIDplus
Zinadril ChemIDplus
Manual Xrefs Databases
1767 VSDB
C07701 KEGG COMPOUND
D00620 KEGG DRUG
DB00542 DrugBank
View more database links
Registry Numbers Types Sources
4286047 Reaxys Registry Number Reaxys
86541-74-4 CAS Registry Number KEGG COMPOUND
86541-74-4 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
17984588 PubMed citation Europe PMC
22469039 PubMed citation Europe PMC
2264573 PubMed citation Europe PMC
26228576 PubMed citation Europe PMC
2853611 PubMed citation Europe PMC
Last Modified
18 September 2018