EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:31911 - Nilvadipine

Default Structure
ChEBI IDCHEBI:31911
ChEBI NameNilvadipine
Stars
Secondary ChEBI IDCHEBI:95208
Last Modified9 March 2018
DownloadsMolfile
FormulaC19H19N3O6
Net Charge0
Average Mass385.376
Monoisotopic Mass385.12739
SMILESCOC(=O)C1=C(C#N)NC(C)=C(C(=O)OC(C)C)C1c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C19H19N3O6/c1-10(2)28-19(24)15-11(3)21-14(9-20)17(18(23)27-4)16(15)12-6-5-7-13(8-12)22(25)26/h5-8,10,16,21H,1-4H3
InChIKeyFAIIFDPAEUKBEP-UHFFFAOYSA-N
Roles Classification
Application:
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
ChEBI Ontology
Outgoing Relation(s)
Nilvadipine (CHEBI:31911) has role cardiovascular drug (CHEBI:35554)
Nilvadipine (CHEBI:31911) is a dihydropyridine (CHEBI:50075)
Nilvadipine (CHEBI:31911) is a isopropyl ester (CHEBI:35725)
Nilvadipine (CHEBI:31911) is a methyl ester (CHEBI:25248)
Nilvadipine (CHEBI:31911) is a nitrile (CHEBI:18379)
Nilvadipine (CHEBI:31911) is a organic molecular entity (CHEBI:50860)
Nilvadipine (CHEBI:31911) is a racemate (CHEBI:60911)
INN  Source
nilvadipinoWHO MedNet
Synonyms  Source
CL 287,389ChEMBL
CL-287,389ChEMBL
CL-287389ChEMBL
Dl-nilvadipineChEMBL
EscorChEMBL
FK 235ChEMBL
Manual XrefsDatabases
1934DrugCentral
D01908KEGG DRUG
HMDB0015657HMDB
LSM-6501LINCS
Registry NumbersSources
CAS:75530-68-6KEGG COMPOUND
CAS:75530-68-6DrugCentral
Citations