Bicarbonate Ion → 1-(3,4,5-Trimethoxy-benzoyl)-3-[2-[4-[1-(4-fluoro-benzyl)-1H-benzoimidazole-2-carbonyl]-piperidin-1-yl]-ethyl]-3-(3,4-dimethoxy-phenyl)-pyrrolidine
Reaction equation
[C:61](=[O:62])([OH:63])[O-:64].[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][S:15]([CH3:16])(=[O:17])=[O:18])([c:19]3[cH:20][c:21]([O:27][CH3:28])[c:22]([O:25][CH3:26])[cH:23][cH:24]3)[CH2:11][CH2:12]2)[cH:29][c:30]([O:34][CH3:35])[c:31]1[O:32][CH3:33].[Cl:66][CH2:67][Cl:68].[F:36][c:37]1[cH:38][cH:39][c:40]([CH2:41][n:42]2[c:43]([C:51](=[O:52])[CH:53]3[CH2:54][CH2:55][NH:56][CH2:57][CH2:58]3)[n:44][c:45]3[c:46]2[cH:47][cH:48][cH:49][cH:50]3)[cH:59][cH:60]1.[Na+:65].[O:70]1[CH2:71][CH2:72][CH2:73][CH2:74]1.[OH2:69]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([C:6](=[O:7])[N:8]2[CH2:9][C:10]([CH2:13][CH2:14][N:56]3[CH2:55][CH2:54][CH:53]([C:51]([c:43]4[n:42]([CH2:41][c:40]5[cH:39][cH:38][c:37]([F:36])[cH:60][cH:59]5)[c:46]5[c:45]([n:44]4)[cH:50][cH:49][cH:48][cH:47]5)=[O:52])[CH2:58][CH2:57]3)([c:19]3[cH:20][c:21]([O:27][CH3:28])[c:22]([O:25][CH3:26])[cH:23][cH:24]3)[CH2:11][CH2:12]2)[cH:29][c:30]([O:34][CH3:35])[c:31]1[O:32][CH3:33]Participants
8
Reactant 7
Product 1
Sources & evidence
- ORD record
- ord-d4244b25f4cb49fb9cb75667bf7288c7
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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