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CHEBI:8024 - perindopril

ChEBI IDCHEBI:8024
ChEBI Nameperindopril
Stars
DefinitionAn α-amino acid ester that is the ethyl ester of N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline
Last Modified22 February 2017
DownloadsMolfile
FormulaC19H32N2O5
Net Charge0
Average Mass368.474
Monoisotopic Mass368.23112
SMILES[H][C@@]12CCCC[C@]1([H])N(C(=O)[C@H](C)N[C@@H](CCC)C(=O)OCC)[C@H](C(=O)O)C2
InChIInChI=1S/C19H32N2O5/c1-4-8-14(19(25)26-5-2)20-12(3)17(22)21-15-10-7-6-9-13(15)11-16(21)18(23)24/h12-16,20H,4-11H2,1-3H3,(H,23,24)/t12-,13-,14-,15-,16-/m0/s1
InChIKeyIPVQLZZIHOAWMC-QXKUPLGCSA-N
Wikipedia
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Role:
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).
Applications:
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).
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
ChEBI Ontology
Outgoing Relation(s)
perindopril (CHEBI:8024) has role antihypertensive agent (CHEBI:35674)
perindopril (CHEBI:8024) has role EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (CHEBI:35457)
perindopril (CHEBI:8024) is a dicarboxylic acid monoester (CHEBI:36244)
perindopril (CHEBI:8024) is a ethyl ester (CHEBI:23990)
perindopril (CHEBI:8024) is a organic heterobicyclic compound (CHEBI:27171)
perindopril (CHEBI:8024) is a α-amino acid ester (CHEBI:46874)
perindopril (CHEBI:8024) is conjugate acid of perindopril(1−) (CHEBI:78000)
Incoming Relation(s)
perindopril(1−) (CHEBI:78000) is conjugate base of perindopril (CHEBI:8024)
IUPAC Name 
ethyl N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvalinate
INNs  Source
perindoprilumChemIDplus
perindoprilChemIDplus
Synonym  Source
(2S,3aS,7aS)-1-[(2S)-2-{[(2S)-1-ethoxy-1-oxopentan-2-yl]amino}propanoyl]octahydro-1H-indole-2-carboxylic acidIUPAC
Manual XrefsDatabases
C07706KEGG COMPOUND
D03753KEGG DRUG
DB00790DrugBank
PerindoprilWikipedia
HMDB0014928HMDB
LSM-4080LINCS
2108DrugCentral
Registry NumbersSources
Reaxys:4300272Reaxys
CAS:82834-16-0KEGG COMPOUND
CAS:82834-16-0ChemIDplus
Citations