Acetic Acid → 3-[3-(3,3-Dimethyl-1-oxo-1-butyl)-5-(quinolin-2-ylmethoxy)indol-2-yl]-2,2-dimethylpropanoic acid
Reaction equation
[C:39]([OH:40])(=[O:41])[CH3:42].[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[CH3:1][C:2]([CH2:3][C:4](=[O:5])[c:6]1[c:7]([CH2:27][C:28]([C:29](=[O:30])[O:31][CH3:32])([CH3:33])[CH3:34])[nH:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][c:17]3[n:18][c:19]4[cH:20][cH:21][cH:22][cH:23][c:24]4[cH:25][cH:26]3)[cH:13][c:14]12)([CH3:35])[CH3:36].[CH3:47][OH:48].[CH:43]([OH:44])([CH3:45])[CH3:46].[Na+:38].[OH-:37].[OH2:54]>>[CH3:1][C:2]([CH2:3][C:4](=[O:5])[c:6]1[c:7]([CH2:27][C:28]([C:29](=[O:30])[OH:31])([CH3:33])[CH3:34])[nH:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH2:16][c:17]3[n:18][c:19]4[cH:20][cH:21][cH:22][cH:23][c:24]4[cH:25][cH:26]3)[cH:13][c:14]12)([CH3:35])[CH3:36]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-20c50dfe6b6044ba93b4bdcd0fc50e83
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…