1-[(1R)-1-(hydroxymethyl)-7-methoxy-1'-spiro[1,2,3,9-tetrahydropyrido[3,4-b]indole-4,4'-piperidine]yl]-2-(3-pyridinyl)ethanone

Properties Image MNX_ID MNXM338716 reference chebi:126726 formula C24H28N4O3 global charge 0 mol weight 420.513 InChIKey NZUADFBIDGBVNA-FQEVSTJZSA-N InChI InChI=1S/C24H28N4O3/c1-31-17-4-5-18-19(12-17)27-23-20(14-29)26-15-24(22(18)23)6-9-28(10-7-24)21(30)11-16-3-2-8-25-13-16/h2-5,8,12-13,20,26-27,29H,6-7,9-11,14-15H2,1H3/t20-/m0/s1 SMILES COC1=CC2=C(C=C1)C1=C(N2)[C@H](CO)NCC12CCN(C(=O)CC1=CN=CC=C1)CC2 MNX internals InChI (mnx) InChI=1/C24H28N4O3/c1-31-17-4-5-18-19(12-17)27-23-20(14-29)26-15-24(22(18)23)6-9-28(10-7-24)21(30)11-16-3-2-8-25-13-16/h2-5,8,12-13,20,26-27,29H,6-7,9-11,14-15H2,1H3/t20-/m0/s1 SMILES (mnx) [CH3:1][O:31][C:17]1=[CH:12][C:19]2=[C:18]([CH:5]=[CH:4]1)[C:22]1=[C:23]([C@H:20]([CH2:14][OH:29])[NH:26][CH2:15][C:24]13[CH2:6][CH2:9][N:28]([C:21]([CH2:11][C:16]1=[CH:13][N:25]=[CH:8][CH:2]=[CH:3]1)=[O:30])[CH2:10][CH2:7]3)[NH:27]2

Parent-child relations graph

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