CHEBI:177391 - Ceronapril

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Ceronapril
ChEBI ID CHEBI:177391
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C21H33N2O6P
Net Charge 0
Average Mass 440.477
Monoisotopic Mass 440.20762
InChI InChI=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
InChIKey IFYLTXNCFVRALQ-OALUTQOASA-N
SMILES P(O[C@H](C(=O)N1[C@@H](CCC1)C(O)=O)CCCCN)(O)(=O)CCCCC2=CC=CC=C2
Metabolite of Species Details
Sus scrofa (NCBI:txid9823) Found in sausage (ENVO:00002166). See: MetaboLights Study
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 Xrefs Databases
164789 ChemSpider
D03440 KEGG DRUG
View more database links
Registry Number Type Source
111223-26-8 CAS Registry Number ChemIDplus