1-[(1R)-1'-(benzenesulfonyl)-1-(hydroxymethyl)-7-methoxy-9-methyl-2-spiro[1,3-dihydropyrido[3,4-b]indole-4,3'-azetidine]yl]ethanone

Properties Image MNX_ID MNXM338688 reference chebi:129163 formula C24H27N3O5S global charge 0 mol weight 469.563 InChIKey XBXLWFPLHJOTBB-NRFANRHFSA-N InChI InChI=1S/C24H27N3O5S/c1-16(29)27-15-24(13-26(14-24)33(30,31)18-7-5-4-6-8-18)22-19-10-9-17(32-3)11-20(19)25(2)23(22)21(27)12-28/h4-11,21,28H,12-15H2,1-3H3/t21-/m0/s1 SMILES COC1=CC2=C(C=C1)C1=C([C@H](CO)N(C(C)=O)CC13CN(S(=O)(=O)C1=CC=CC=C1)C3)N2C MNX internals InChI (mnx) InChI=1/C24H27N3O5S/c1-16(29)27-15-24(13-26(14-24)33(30,31)18-7-5-4-6-8-18)22-19-10-9-17(32-3)11-20(19)25(2)23(22)21(27)12-28/h4-11,21,28H,12-15H2,1-3H3/t21-/m0/s1 SMILES (mnx) [CH3:1][C:16]([N:27]1[CH2:15][C:24]2([CH2:13][N:26]([S:33]([C:18]3=[CH:7][CH:5]=[CH:4][CH:6]=[CH:8]3)(=[O:30])=[O:31])[CH2:14]2)[C:22]2=[C:23]([C@@H:21]1[CH2:12][OH:28])[N:25]([CH3:2])[C:20]1=[C:19]2[CH:10]=[CH:9][C:17]([O:32][CH3:3])=[CH:11]1)=[O:29]

Parent-child relations graph

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