Sodium ion → 2-(3-((3-(Isoquinolin-5-ylamino)pyrrolidin-1-yl)methyl)phenoxy)ethyl benzoate
Reaction equation
[C:1]([OH:2])(=[O:3])[CH2:4][CH2:5][C:6]([OH:7])=[O:8].[C:25]([c:26]1[cH:27][cH:28][cH:29][cH:30][cH:31]1)(=[O:32])[O:33][CH2:34][CH2:35][O:36][c:37]1[cH:38][c:39]([CH:43]=[O:44])[cH:40][cH:41][cH:42]1.[C:45]([O:46][BH-:47]([O:48][C:49](=[O:50])[CH3:51])[O:52][C:53](=[O:54])[CH3:55])(=[O:56])[CH3:57].[NH:9]1[CH2:10][CH:11]([NH:14][c:15]2[c:16]3[cH:17][cH:18][n:19][cH:20][c:21]3[cH:22][cH:23][cH:24]2)[CH2:12][CH2:13]1.[Na+:58].[O:59]1[CH2:60][CH2:61][CH2:62][CH2:63]1>>[N:9]1([CH2:43][c:39]2[cH:38][c:37]([O:36][CH2:35][CH2:34][O:33][C:25]([c:26]3[cH:27][cH:28][cH:29][cH:30][cH:31]3)=[O:32])[cH:42][cH:41][cH:40]2)[CH2:10][CH:11]([NH:14][c:15]2[c:16]3[cH:17][cH:18][n:19][cH:20][c:21]3[cH:22][cH:23][cH:24]2)[CH2:12][CH2:13]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-4e5d9ff2245a4ddf847ddd44e8a3e4bd
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
Loading…