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CHEBI:177593 - libenzapril

ChEBI IDCHEBI:177593
ChEBI Namelibenzapril
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC18H25N3O5
Net Charge0
Average Mass363.414
Monoisotopic Mass363.17942
SMILESNCCCC[C@H](N[C@H]1CCc2ccccc2N(CC(=O)O)C1=O)C(=O)O
InChIInChI=1S/C18H25N3O5/c19-10-4-3-6-14(18(25)26)20-13-9-8-12-5-1-2-7-15(12)21(17(13)24)11-16(22)23/h1-2,5,7,13-14,20H,3-4,6,8-11,19H2,(H,22,23)(H,25,26)/t13-,14-/m0/s1
InChIKeyAXTCRUUITQKBAV-KBPBESRZSA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
libenzapril (CHEBI:177593) is a dipeptide (CHEBI:46761)
IUPAC Name 
(2S)-6-amino-2-[[(3S)-1-(carboxymethyl)-2-oxo-4,5-dihydro-3H-1-benzazepin-3-yl]amino]hexanoic acid
Manual XrefsDatabases
64428ChemSpider
D03758KEGG DRUG
Registry NumbersSources
CAS:109214-55-3ChemIDplus