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CHEBI:92584 - (3S,4R)-1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-4-piperidinecarboxylic acid

ChEBI IDCHEBI:92584
ChEBI Name(3S,4R)-1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-4-piperidinecarboxylic acid
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DownloadsMolfile
FormulaC26H29FN2O2
Net Charge0
Average Mass420.528
Monoisotopic Mass420.22131
SMILESC[C@@H]1CN(C2CCC(C#N)(c3ccc(F)cc3)CC2)CC[C@]1(C(=O)O)c1ccccc1
InChIInChI=1S/C26H29FN2O2/c1-19-17-29(16-15-26(19,24(30)31)21-5-3-2-4-6-21)23-11-13-25(18-28,14-12-23)20-7-9-22(27)10-8-20/h2-10,19,23H,11-17H2,1H3,(H,30,31)/t19-,23?,25?,26-/m1/s1
InChIKeyZCGOMHNNNFPNMX-YHYDXASRSA-N
ChEBI Ontology
Outgoing Relation(s)
(3S,4R)-1-[4-cyano-4-(4-fluorophenyl)cyclohexyl]-3-methyl-4-phenyl-4-piperidinecarboxylic acid (CHEBI:92584) is a piperidines (CHEBI:26151)
Manual XrefsDatabases
LSM-2731LINCS
HMDB0015238HMDB