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CHEBI:177391 - Ceronapril

ChEBI IDCHEBI:177391
ChEBI NameCeronapril
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H33N2O6P
Net Charge0
Average Mass440.477
Monoisotopic Mass440.20762
SMILESNCCCC[C@H](OP(=O)(O)CCCCc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O
InChIInChI=1S/C21H33N2O6P/c22-14-6-4-13-19(20(24)23-15-8-12-18(23)21(25)26)29-30(27,28)16-7-5-11-17-9-2-1-3-10-17/h1-3,9-10,18-19H,4-8,11-16,22H2,(H,25,26)(H,27,28)/t18-,19-/m0/s1
InChIKeyIFYLTXNCFVRALQ-OALUTQOASA-N
Species of MetaboliteComponentSourceComments
Sus scrofa (ncbitaxon:9823) sausage (ENVO:00002166) MetaboLights (MTBLS2871)
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
Ceronapril (CHEBI:177391) is a N-acyl-amino acid (CHEBI:51569)
IUPAC Name 
(2S)-1-[(2S)-6-amino-2-[hydroxy(4-phenylbutyl)phosphoryl]oxyhexanoyl]pyrrolidine-2-carboxylic acid
Manual XrefsDatabases
164789ChemSpider
D03440KEGG DRUG
Registry NumbersSources
CAS:111223-26-8ChemIDplus