(1S)-N-cyclopentyl-2-(cyclopropylmethyl)-1-(hydroxymethyl)-7-methoxy-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3'-azetidine]carboxamide

Properties Image MNX_ID MNXM169902 reference chebi:126185 formula C25H34N4O3 global charge 0 mol weight 438.572 InChIKey YOMIOEXLRSAPBQ-OAQYLSRUSA-N InChI InChI=1S/C25H34N4O3/c1-32-18-8-9-19-20(10-18)27-23-21(12-30)28(11-16-6-7-16)13-25(22(19)23)14-29(15-25)24(31)26-17-4-2-3-5-17/h8-10,16-17,21,27,30H,2-7,11-15H2,1H3,(H,26,31)/t21-/m1/s1 SMILES COC1=CC2=C(C=C1)C1=C(N2)[C@@H](CO)N(CC2CC2)CC12CN(C(=O)NC1CCCC1)C2 MNX internals InChI (mnx) InChI=1/C25H34N4O3/c1-32-18-8-9-19-20(10-18)27-23-21(12-30)28(11-16-6-7-16)13-25(22(19)23)14-29(15-25)24(31)26-17-4-2-3-5-17/h8-10,16-17,21,27,30H,2-7,11-15H2,1H3,(H,26,31)/t21-/m1/s1 SMILES (mnx) [CH3:1][O:32][C:18]1=[CH:10][C:20]2=[C:19]([CH:9]=[CH:8]1)[C:22]1=[C:23]([C@@H:21]([CH2:12][OH:30])[N:28]([CH2:11][CH:16]3[CH2:6][CH2:7]3)[CH2:13][C:25]13[CH2:14][N:29]([C:24](=[N:26][CH:17]1[CH2:4][CH2:2][CH2:3][CH2:5]1)[OH:31])[CH2:15]3)[NH:27]2

Parent-child relations graph

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