1-[(2S,3S)-6-acetyl-2-(hydroxymethyl)-3-[4-(2-methylphenyl)phenyl]-1,6-diazaspiro[3.3]heptan-1-yl]-2-cyclopropylethanone

Properties Image MNX_ID MNXM339764 reference chebi:125862 formula C26H30N2O3 global charge 0 mol weight 418.537 InChIKey YFWUDGWAZBUJGR-NOZRDPDXSA-N InChI InChI=1S/C26H30N2O3/c1-17-5-3-4-6-22(17)20-9-11-21(12-10-20)25-23(14-29)28(24(31)13-19-7-8-19)26(25)15-27(16-26)18(2)30/h3-6,9-12,19,23,25,29H,7-8,13-16H2,1-2H3/t23-,25+/m1/s1 SMILES CC(=O)N1CC2(C1)[C@@H](C1=CC=C(C3=CC=CC=C3C)C=C1)[C@@H](CO)N2C(=O)CC1CC1 MNX internals InChI (mnx) InChI=1/C26H30N2O3/c1-17-5-3-4-6-22(17)20-9-11-21(12-10-20)25-23(14-29)28(24(31)13-19-7-8-19)26(25)15-27(16-26)18(2)30/h3-6,9-12,19,23,25,29H,7-8,13-16H2,1-2H3/t23-,25+/m1/s1 SMILES (mnx) [CH3:1][C:17]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:22]1[C:20]1=[CH:10][CH:12]=[C:21]([C@H:25]2[C@@H:23]([CH2:14][OH:29])[N:28]([C:24]([CH2:13][CH:19]3[CH2:7][CH2:8]3)=[O:31])[C:26]23[CH2:15][N:27]([C:18]([CH3:2])=[O:30])[CH2:16]3)[CH:11]=[CH:9]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0