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CHEBI:31247 - Azelnidipine

ChEBI IDCHEBI:31247
ChEBI NameAzelnidipine
Stars
Last Modified9 March 2018
DownloadsMolfile
FormulaC33H34N4O6
Net Charge0
Average Mass582.657
Monoisotopic Mass582.24783
SMILESCC1=C(C(=O)OC(C)C)C(c2cccc([N+](=O)[O-])c2)C(C(=O)OC2CN(C(c3ccccc3)c3ccccc3)C2)=C(N)N1
InChIInChI=1S/C33H34N4O6/c1-20(2)42-32(38)27-21(3)35-31(34)29(28(27)24-15-10-16-25(17-24)37(40)41)33(39)43-26-18-36(19-26)30(22-11-6-4-7-12-22)23-13-8-5-9-14-23/h4-17,20,26,28,30,35H,18-19,34H2,1-3H3
InChIKeyZKFQEACEUNWPMT-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
Azelnidipine (CHEBI:31247) is a isopropyl ester (CHEBI:35725)
Synonyms  Source
AzelnidipineKEGG COMPOUND
calblockDrugCentral
CS-905DrugCentral
Manual XrefsDatabases
D01145KEGG DRUG
272DrugCentral
Registry NumbersSources
CAS:123524-52-7KEGG COMPOUND