Acetic Acid → Acetic Acid
Reaction equation
[CH3:1][C:2]([OH:3])=[O:4].[CH3:5][NH:6][CH2:7][C:8](=[O:9])[O:10][CH:11]([CH2:12][n:13]1[n:14](-[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:15](=[O:41])[c:16]([C:19]([NH:20][c:21]2[n:22][cH:23][c:24]([O:27][c:28]3[cH:29][cH:30][n:31][c:32]4[cH:33][c:34]([O:38][CH3:39])[cH:35][cH:36][c:37]34)[cH:25][cH:26]2)=[O:40])[c:17]1[CH3:18])[CH3:48]>>[CH3:1][C:2](=[O:3])[OH:4].[CH3:5][NH:6][CH2:7][C:8](=[O:9])[O:10][CH:11]([CH2:12][n:13]1[n:14](-[c:42]2[cH:43][cH:44][cH:45][cH:46][cH:47]2)[c:15](=[O:41])[c:16]([C:19]([NH:20][c:21]2[n:22][cH:23][c:24]([O:27][c:28]3[cH:29][cH:30][n:31][c:32]4[cH:33][c:34]([O:38][CH3:39])[cH:35][cH:36][c:37]34)[cH:25][cH:26]2)=[O:40])[c:17]1[CH3:18])[CH3:48]Participants
4
Sources & evidence
- ORD record
- ord-baa8cbcda2164d0e887837cb4dbd5ae9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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