Methanol → 3-{4-[1-(4'-tert-Butyl-biphenyl-4-ylamino)-3-methyl-butyl]-benzoylamino}-propionic acid
Reaction equation
[CH3:1][O:2][C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[NH:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([C:32]([CH3:33])([CH3:34])[CH3:35])[cH:30][cH:31]3)[cH:24][cH:25]2)[cH:12][cH:13]1)=[O:36])=[O:37].[CH3:38][OH:39].[CH3:42][CH2:43][O:44][C:45]([CH3:46])=[O:47].[Na+:41].[OH-:40]>>[O:2]=[C:3]([CH2:4][CH2:5][NH:6][C:7]([c:8]1[cH:9][cH:10][c:11]([CH:14]([CH2:15][CH:16]([CH3:17])[CH3:18])[NH:19][c:20]2[cH:21][cH:22][c:23](-[c:26]3[cH:27][cH:28][c:29]([C:32]([CH3:33])([CH3:34])[CH3:35])[cH:30][cH:31]3)[cH:24][cH:25]2)[cH:12][cH:13]1)=[O:36])[OH:37]Participants
6
Sources & evidence
- ORD record
- ord-9efffd9c99924e79bda9bca2f18c9cd3
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
Reaction notes
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