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CHEBI:98041 - (2S,3S,4R)-2-cyano-N-cyclohexyl-4-(hydroxymethyl)-3-[4-(4-methoxyphenyl)phenyl]azetidine-1-carboxamide

ChEBI IDCHEBI:98041
ChEBI Name(2S,3S,4R)-2-cyano-N-cyclohexyl-4-(hydroxymethyl)-3-[4-(4-methoxyphenyl)phenyl]azetidine-1-carboxamide
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FormulaC25H29N3O3
Net Charge0
Average Mass419.525
Monoisotopic Mass419.22089
SMILESCOc1ccc(-c2ccc([C@H]3[C@@H](C#N)N(C(=O)NC4CCCCC4)[C@H]3CO)cc2)cc1
InChIInChI=1S/C25H29N3O3/c1-31-21-13-11-18(12-14-21)17-7-9-19(10-8-17)24-22(15-26)28(23(24)16-29)25(30)27-20-5-3-2-4-6-20/h7-14,20,22-24,29H,2-6,16H2,1H3,(H,27,30)/t22-,23+,24+/m1/s1
InChIKeyUEJLJRRJJUOYFY-SGNDLWITSA-N
ChEBI Ontology
Outgoing Relation(s)
(2S,3S,4R)-2-cyano-N-cyclohexyl-4-(hydroxymethyl)-3-[4-(4-methoxyphenyl)phenyl]azetidine-1-carboxamide (CHEBI:98041) is a biphenyls (CHEBI:22888)
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