Sodium ion → [3-[[4-hydroxy-4-(1,3-oxazol-2-yl)cyclohexyl]amino]-1-propan-2-ylcyclopentyl]-[7-(trifluoromethyl)-3,4-dihydro-1H-isoquinolin-2-yl]methanone
Reaction equation
[C:46]([O:47][BH-:48]([O:49][C:50](=[O:51])[CH3:52])[O:53][C:54](=[O:55])[CH3:56])(=[O:57])[CH3:58].[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[CH3:39][CH2:40][N:41]([CH2:42][CH3:43])[CH2:44][CH3:45].[CH:1]([CH3:2])([CH3:3])[C:4]1([C:10](=[O:11])[N:12]2[CH2:13][c:14]3[cH:15][c:16]([C:22]([F:23])([F:24])[F:25])[cH:17][cH:18][c:19]3[CH2:20][CH2:21]2)[CH2:5][CH:6]([NH2:9])[CH2:7][CH2:8]1.[Na+:59].[OH:26][C:27]1([c:34]2[o:35][cH:36][cH:37][n:38]2)[CH2:28][CH2:29][C:30](=[O:33])[CH2:31][CH2:32]1>>[CH:1]([CH3:2])([CH3:3])[C:4]1([C:10](=[O:11])[N:12]2[CH2:13][c:14]3[cH:15][c:16]([C:22]([F:23])([F:24])[F:25])[cH:17][cH:18][c:19]3[CH2:20][CH2:21]2)[CH2:5][CH:6]([NH:9][CH:30]2[CH2:29][CH2:28][C:27]([OH:26])([c:34]3[o:35][cH:36][cH:37][n:38]3)[CH2:32][CH2:31]2)[CH2:7][CH2:8]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-abaedc4b1a9e452686531b3a271b4476
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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