CHEBI:6503 - lisinopril dihydrate

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ChEBI Name lisinopril dihydrate
ChEBI ID CHEBI:6503
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formulae C21H31N3O5.2H2O
C21H35N3O7
Net Charge 0
Average Mass 441.51862
Monoisotopic Mass 441.24750
InChI InChI=1S/C21H31N3O5.2H2O/c22-13-5-4-9-16(19(25)24-14-6-10-18(24)21(28)29)23-17(20(26)27)12-11-15-7-2-1-3-8-15;;/h1-3,7-8,16-18,23H,4-6,9-14,22H2,(H,26,27)(H,28,29);2*1H2/t16-,17-,18-;;/m0../s1
InChIKey CZRQXSDBMCMPNJ-ZUIPZQNBSA-N
SMILES [H]O[H].[H]O[H].NCCCC[C@H](N[C@@H](CCc1ccccc1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
Roles Classification
Application(s): antihypertensive agent
Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
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ChEBI Ontology
Outgoing lisinopril dihydrate (CHEBI:6503) has part lisinopril (CHEBI:43755)
lisinopril dihydrate (CHEBI:6503) has role antihypertensive agent (CHEBI:35674)
lisinopril dihydrate (CHEBI:6503) is a hydrate (CHEBI:35505)
IUPAC Name
N2-[(1S)-1-carboxy-3-phenylpropyl]-L-lysyl-L-proline dihydrate
Synonyms Sources
(S)-1-(N2-(1-carboxy-3-phenylpropyl)-L-lysyl)-L-proline dihydrate ChemIDplus
Lisinopril ChemIDplus
Lisinopril dihydrate ChemIDplus
Renacor ChemIDplus
Manual Xref Database
D00362 KEGG DRUG
View more database links
Registry Numbers Types Sources
83915-83-7 CAS Registry Number ChemIDplus
9460785 Beilstein Registry Number Beilstein
Last Modified
17 October 2009