Hydrochloric Acid → 2-[2-(3,5-Difluoro-benzylcarbamoyl)-propionylamino]-3-(1H-indol-3-yl)-propionic acid tert-butyl ester
Reaction equation
[B-:38]([F:39])([F:40])([F:41])[F:42].[C:19]([CH3:20])([CH3:21])([CH3:22])[O:23][C:24]([CH:25]([NH2:26])[CH2:27][c:28]1[cH:29][nH:30][c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]12)=[O:37].[CH2:60]([N:61]([CH2:62][CH3:63])[CH2:64][CH3:65])[CH3:66].[ClH:18].[F:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7]([CH:8]([C:9](=[O:10])[OH:11])[CH3:12])=[O:13])[cH:14][c:15]([F:17])[cH:16]1.[O:67]=[CH:68][N:69]([CH3:70])[CH3:71].[OH2:72].[n:43]1([O:44][C:45]([N:46]([CH3:47])[CH3:48])=[N+:49]([CH3:50])[CH3:51])[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[F:1][c:2]1[cH:3][c:4]([CH2:5][NH:6][C:7]([CH:8]([C:9](=[O:11])[NH:26][CH:25]([C:24]([O:23][C:19]([CH3:20])([CH3:21])[CH3:22])=[O:37])[CH2:27][c:28]2[cH:29][nH:30][c:31]3[cH:32][cH:33][cH:34][cH:35][c:36]23)[CH3:12])=[O:13])[cH:14][c:15]([F:17])[cH:16]1Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-f106e0c00ab24a1caf74a3309539e67a
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
Reaction notes
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