CHEBI:130433 - (2R,3S,4R)-2-cyano-3-[4-(1-cyclohexenyl)phenyl]-N-cyclohexyl-4-(hydroxymethyl)-1-azetidinecarboxamide

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ChEBI Name (2R,3S,4R)-2-cyano-3-[4-(1-cyclohexenyl)phenyl]-N-cyclohexyl-4-(hydroxymethyl)-1-azetidinecarboxamide
ChEBI ID CHEBI:130433
Stars This entity has been manually annotated by a third party.
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Formula C24H31N3O2
Net Charge 0
Average Mass 393.523
Monoisotopic Mass 393.24163
InChI InChI=1S/C24H31N3O2/c25-15-21-23(19-13-11-18(12-14-19)17-7-3-1-4-8-17)22(16-28)27(21)24(29)26-20-9-5-2-6-10-20/h7,11-14,20-23,28H,1-6,8-10,16H2,(H,26,29)/t21-,22-,23-/m0/s1
InChIKey NGEJRVOWBBAFCN-VABKMULXSA-N
SMILES C1CCC(CC1)NC(=O)N2[C@H]([C@H]([C@@H]2C#N)C3=CC=C(C=C3)C4=CCCCC4)CO
ChEBI Ontology
Outgoing (2R,3S,4R)-2-cyano-3-[4-(1-cyclohexenyl)phenyl]-N-cyclohexyl-4-(hydroxymethyl)-1-azetidinecarboxamide (CHEBI:130433) is a azetidines (CHEBI:38777)
(2R,3S,4R)-2-cyano-3-[4-(1-cyclohexenyl)phenyl]-N-cyclohexyl-4-(hydroxymethyl)-1-azetidinecarboxamide (CHEBI:130433) is a benzenes (CHEBI:22712)
(2R,3S,4R)-2-cyano-3-[4-(1-cyclohexenyl)phenyl]-N-cyclohexyl-4-(hydroxymethyl)-1-azetidinecarboxamide (CHEBI:130433) is a ring assembly (CHEBI:36820)
Manual Xref Database
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