1-[(1R)-2-[(2-chlorophenyl)methyl]-1-(hydroxymethyl)-7-methoxy-9-methyl-1'-spiro[1,3-dihydropyrido[3,4-b]indole-4,4'-piperidine]yl]-2-cyclopropylethanone

Properties Image MNX_ID MNXM338752 reference chebi:130423 formula C30H36ClN3O3 global charge 0 mol weight 522.089 InChIKey MDSJDARPNRSSLZ-SANMLTNESA-N InChI InChI=1S/C30H36ClN3O3/c1-32-25-16-22(37-2)9-10-23(25)28-29(32)26(18-35)34(17-21-5-3-4-6-24(21)31)19-30(28)11-13-33(14-12-30)27(36)15-20-7-8-20/h3-6,9-10,16,20,26,35H,7-8,11-15,17-19H2,1-2H3/t26-/m0/s1 SMILES COC1=CC2=C(C=C1)C1=C([C@H](CO)N(CC3=CC=CC=C3Cl)CC13CCN(C(=O)CC1CC1)CC3)N2C MNX internals InChI (mnx) InChI=1/C30H36ClN3O3/c1-32-25-16-22(37-2)9-10-23(25)28-29(32)26(18-35)34(17-21-5-3-4-6-24(21)31)19-30(28)11-13-33(14-12-30)27(36)15-20-7-8-20/h3-6,9-10,16,20,26,35H,7-8,11-15,17-19H2,1-2H3/t26-/m0/s1 SMILES (mnx) [CH3:1][N:32]1[C:25]2=[C:23]([CH:10]=[CH:9][C:22]([O:37][CH3:2])=[CH:16]2)[C:28]2=[C:29]1[C@H:26]([CH2:18][OH:35])[N:34]([CH2:17][C:21]1=[CH:5][CH:3]=[CH:4][CH:6]=[C:24]1[Cl:31])[CH2:19][C:30]21[CH2:11][CH2:13][N:33]([C:27]([CH2:15][CH:20]2[CH2:7][CH2:8]2)=[O:36])[CH2:14][CH2:12]1

Parent-child relations graph

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