EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:31399 - cilnidipine

Default Structure
ChEBI IDCHEBI:31399
ChEBI Namecilnidipine
Stars
DefinitionA diesterified 1,4-dihydropyridine-3,5-dicarboxylic acid. A calcium channel blocker, it is used as an antihypertensive.
Secondary ChEBI IDCHEBI:551341
Last Modified13 April 2017
DownloadsMolfile
FormulaC27H28N2O7
Net Charge0
Average Mass492.528
Monoisotopic Mass492.18965
SMILESCOCCOC(=O)C1=C(C)NC(C)=C(C(=O)OC/C=C/c2ccccc2)C1c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C27H28N2O7/c1-18-23(26(30)35-14-8-11-20-9-5-4-6-10-20)25(21-12-7-13-22(17-21)29(32)33)24(19(2)28-18)27(31)36-16-15-34-3/h4-13,17,25,28H,14-16H2,1-3H3/b11-8+
InChIKeyKJEBULYHNRNJTE-DHZHZOJOSA-N
Wikipedia
Roles Classification
Biological Role:
calcium channel blocker  One of a class of drugs that acts by selective inhibition of calcium influx through cell membranes or on the release and binding of calcium in intracellular pools.
Applications:
antihypertensive agent  Any drug used in the treatment of acute or chronic vascular hypertension regardless of pharmacological mechanism.
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
ChEBI Ontology
Outgoing Relation(s)
cilnidipine (CHEBI:31399) has role antihypertensive agent (CHEBI:35674)
cilnidipine (CHEBI:31399) has role calcium channel blocker (CHEBI:38215)
cilnidipine (CHEBI:31399) has role cardiovascular drug (CHEBI:35554)
cilnidipine (CHEBI:31399) is a C-nitro compound (CHEBI:35716)
cilnidipine (CHEBI:31399) is a 2-methoxyethyl ester (CHEBI:136838)
cilnidipine (CHEBI:31399) is a dihydropyridine (CHEBI:50075)
IUPAC Name 
2-methoxyethyl (2E)-3-phenylprop-2-en-1-yl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
INN  Source
cilnidipineChemIDplus
Synonym  Source
(±)-(E)-cinnamyl 2-methoxyethyl 1,4-dihydro-2,6-dimethyl-4-(m-nitrophenyl)-3,5-pyridinedicarboxylateChemIDplus
Manual XrefsDatabases
642DrugCentral
CilnidipineWikipedia
D01173KEGG DRUG
EP161877Patent
US4672068Patent
Registry NumbersSources
CAS:132203-70-4ChemIDplus