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CHEBI:103932 - (4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-(4,4-diphenyl-1-piperidinyl)propyl] ester O3-methyl ester

Default Structure
ChEBI IDCHEBI:103932
ChEBI Name(4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-(4,4-diphenyl-1-piperidinyl)propyl] ester O3-methyl ester
Stars
Last Modified22 February 2017
DownloadsMolfile
FormulaC36H39N3O6
Net Charge0
Average Mass609.723
Monoisotopic Mass609.28389
SMILESCOC(=O)C1=C(C)NC(C)=C(C(=O)OCCCN2CCC(c3ccccc3)(c3ccccc3)CC2)[C@@H]1c1cccc([N+](=O)[O-])c1
InChIInChI=1S/C36H39N3O6/c1-25-31(34(40)44-3)33(27-12-10-17-30(24-27)39(42)43)32(26(2)37-25)35(41)45-23-11-20-38-21-18-36(19-22-38,28-13-6-4-7-14-28)29-15-8-5-9-16-29/h4-10,12-17,24,33,37H,11,18-23H2,1-3H3/t33-/m1/s1
InChIKeySVJMLYUFVDMUHP-MGBGTMOVSA-N
ChEBI Ontology
Outgoing Relation(s)
(4R)-2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O5-[3-(4,4-diphenyl-1-piperidinyl)propyl] ester O3-methyl ester (CHEBI:103932) is a diarylmethane (CHEBI:51614)
Synonyms  Source
B8509-035DrugCentral
B 859-35DrugCentral
B859-35DrugCentral
(+)-NiguldipineDrugCentral
niguldipine fumarateDrugCentral
niguldipine HClDrugCentral
Manual XrefsDatabases
837DrugCentral
LSM-15285LINCS
Registry NumbersSources
CAS:120054-86-6DrugCentral