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CHEBI:141520 - imidaprilat

ChEBI IDCHEBI:141520
ChEBI Nameimidaprilat
Stars
DefinitionA member of the class of imidazolidines that is imidapril in which the ethyl ester group has been hydrolysed to the corresponding acid group. It is the active metabolite of imidapril used to treat hypertension.
Last Modified2 August 2018
SubmitterBijay
DownloadsMolfile
FormulaC18H23N3O6
Net Charge0
Average Mass377.397
Monoisotopic Mass377.15869
SMILESC[C@H](N[C@@H](CCc1ccccc1)C(=O)O)C(=O)N1C(=O)N(C)C[C@H]1C(=O)O
InChIInChI=1S/C18H23N3O6/c1-11(15(22)21-14(17(25)26)10-20(2)18(21)27)19-13(16(23)24)9-8-12-6-4-3-5-7-12/h3-7,11,13-14,19H,8-10H2,1-2H3,(H,23,24)(H,25,26)/t11-,13-,14-/m0/s1
InChIKeyVFAVNRVDTAPBNR-UBHSHLNASA-N
Roles Classification
Chemical Roles:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
Biological Roles:
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:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
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).
ChEBI Ontology
Outgoing Relation(s)
imidaprilat (CHEBI:141520) has functional parent imidapril (CHEBI:135654)
imidaprilat (CHEBI:141520) has role antihypertensive agent (CHEBI:35674)
imidaprilat (CHEBI:141520) has role drug metabolite (CHEBI:49103)
imidaprilat (CHEBI:141520) has role EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor (CHEBI:35457)
imidaprilat (CHEBI:141520) is a N-acylurea (CHEBI:74266)
imidaprilat (CHEBI:141520) is a dicarboxylic acid (CHEBI:35692)
imidaprilat (CHEBI:141520) is a dipeptide (CHEBI:46761)
imidaprilat (CHEBI:141520) is a imidazolidines (CHEBI:38261)
imidaprilat (CHEBI:141520) is a secondary amino compound (CHEBI:50995)
IUPAC Name 
(4S)-3-{N-[(1S)-1-carboxy-3-phenylpropyl]-L-alanyl}-1-methyl-2-oxoimidazolidine-4-carboxylic acid
INNs  Source
imidaprilatChemIDplus
imidaprilatumWHO MedNet
imidaprilateWHO MedNet
imidaprilatWHO MedNet
Synonym  Source
(4S)-1-methyl-3-{(2S)-2-[N-((1S)-1-carboxy-3-phenylpropyl)amino]propionyl}-2-oxo-imidazolidine-4-carboxylic acidChEBI
Manual XrefsDatabases
C21519KEGG COMPOUND
Registry NumbersSources
Reaxys:5857382Reaxys
CAS:89371-44-8ChemIDplus
Citations