1-[(1R)-1-(hydroxymethyl)-7-methoxy-2-[(4-methoxyphenyl)methyl]-1'-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4'-piperidine]yl]-2-pyridin-4-ylethanone

Properties Image MNX_ID MNXM338724 reference chebi:124981 formula C32H36N4O4 global charge 0 mol weight 540.664 InChIKey LPVAXFVUYYVBEP-NDEPHWFRSA-N InChI InChI=1S/C32H36N4O4/c1-39-24-5-3-23(4-6-24)19-36-21-32(11-15-35(16-12-32)29(38)17-22-9-13-33-14-10-22)30-26-8-7-25(40-2)18-27(26)34-31(30)28(36)20-37/h3-10,13-14,18,28,34,37H,11-12,15-17,19-21H2,1-2H3/t28-/m0/s1 SMILES COC1=CC=C(CN2CC3(CCN(C(=O)CC4=CC=NC=C4)CC3)C3=C(NC4=C3C=CC(OC)=C4)[C@@H]2CO)C=C1 MNX internals InChI (mnx) InChI=1/C32H36N4O4/c1-39-24-5-3-23(4-6-24)19-36-21-32(11-15-35(16-12-32)29(38)17-22-9-13-33-14-10-22)30-26-8-7-25(40-2)18-27(26)34-31(30)28(36)20-37/h3-10,13-14,18,28,34,37H,11-12,15-17,19-21H2,1-2H3/t28-/m0/s1 SMILES (mnx) [CH3:1][O:39][C:24]1=[CH:6][CH:4]=[C:23]([CH2:19][N:36]2[CH2:21][C:32]3([CH2:11][CH2:15][N:35]([C:29]([CH2:17][C:22]4=[CH:10][CH:14]=[N:33][CH:13]=[CH:9]4)=[O:38])[CH2:16][CH2:12]3)[C:30]3=[C:31]([C@@H:28]2[CH2:20][OH:37])[NH:34][C:27]2=[C:26]3[CH:8]=[CH:7][C:25]([O:40][CH3:2])=[CH:18]2)[CH:3]=[CH:5]1

Parent-child relations graph

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