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CHEBI:7582 - nitrendipine

Default Structure
ChEBI IDCHEBI:7582
ChEBI Namenitrendipine
Stars
DefinitionA dihydropyridine that is 1,4-dihydropyridine substituted by methyl groups at positions 2 and 6, a 3-nitrophenyl group at position 4, a ethoxycarbonyl group at position 3 and a methoxycarbonyl group at position 5. It is a calcium-channel blocker used in the treatment of hypertension.
Last Modified26 October 2021
DownloadsMolfile
FormulaC18H20N2O6
Net Charge0
Average Mass360.366
Monoisotopic Mass360.13214
SMILESCCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C18H20N2O6/c1-5-26-18(22)15-11(3)19-10(2)14(17(21)25-4)16(15)12-7-6-8-13(9-12)20(23)24/h6-9,16,19H,5H2,1-4H3
InChIKeyPVHUJELLJLJGLN-UHFFFAOYSA-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.
geroprotector  Any compound that supports healthy aging, slows the biological aging process, or extends lifespan.
cardiovascular drug  A drug that affects the rate or intensity of cardiac contraction, blood vessel diameter or blood volume.
vasodilator agent  A drug used to cause dilation of the blood vessels.
ChEBI Ontology
Outgoing Relation(s)
nitrendipine (CHEBI:7582) has role antihypertensive agent (CHEBI:35674)
nitrendipine (CHEBI:7582) has role calcium channel blocker (CHEBI:38215)
nitrendipine (CHEBI:7582) has role cardiovascular drug (CHEBI:35554)
nitrendipine (CHEBI:7582) has role geroprotector (CHEBI:176497)
nitrendipine (CHEBI:7582) has role vasodilator agent (CHEBI:35620)
nitrendipine (CHEBI:7582) is a C-nitro compound (CHEBI:35716)
nitrendipine (CHEBI:7582) is a dicarboxylic acids and O-substituted derivatives (CHEBI:131927)
nitrendipine (CHEBI:7582) is a diester (CHEBI:51307)
nitrendipine (CHEBI:7582) is a dihydropyridine (CHEBI:50075)
nitrendipine (CHEBI:7582) is a ethyl ester (CHEBI:23990)
nitrendipine (CHEBI:7582) is a methyl ester (CHEBI:25248)
IUPAC Name 
ethyl methyl 2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
INNs  Source
nitrendipineChemIDplus
nitrendipinoChemIDplus
nitrendipinumChemIDplus
Synonyms  Source
1,4-dihydro-2,6-dimethyl-4-(3-nitrophenyl)-3,5-pyridinedicarboxylic acid ethyl methyl esterChemIDplus
BAY e 5009ChemIDplus
(+/-)-BAY-E-5009ChEMBL
BAY-E-5009ChEMBL
NSC-758466ChEMBL
Brand Names  Source
BayotensinChemIDplus
BaypressKEGG DRUG
BylotensinChEBI
DeitenChEBI
NidrelChemIDplus
Manual XrefsDatabases
1947DrugCentral
C07713KEGG COMPOUND
CN101416954Patent
D00629KEGG DRUG
DB01054DrugBank
DE2117571Patent
HMDB0015187HMDB
LSM-1246LINCS
NitrendipineWikipedia
US3799934Patent
Registry NumbersSources
Reaxys:498823Reaxys
CAS:39562-70-4KEGG COMPOUND
CAS:39562-70-4NIST Chemistry WebBook
Citations