Acetic Acid → HCID 68486762, compound
Reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:15]2[cH:16][cH:17][cH:18][c:19](-[c:21]3[c:22]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([CH:31]5[CH2:32][CH2:33][N:34]([C:37]([O:38][C:39]([CH3:40])([CH3:41])[CH3:42])=[O:43])[CH2:35][CH2:36]5)[cH:29][cH:30]4)[c:44]([F:48])[cH:45][cH:46][cH:47]3)[n:20]2)[c:10]1[C:11]([F:12])([F:13])[F:14].[CH3:49][C:50](=[O:51])[OH:52].[OH2:53]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][n:8][n:9](-[c:15]2[cH:16][cH:17][cH:18][c:19](-[c:21]3[c:22]([O:23][CH2:24][c:25]4[cH:26][cH:27][c:28]([CH:31]5[CH2:32][CH2:33][NH:34][CH2:35][CH2:36]5)[cH:29][cH:30]4)[c:44]([F:48])[cH:45][cH:46][cH:47]3)[n:20]2)[c:10]1[C:11]([F:12])([F:13])[F:14]Participants
4
Sources & evidence
- ORD record
- ord-b0c0cff644ed4d479f28030b80874024
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
Reaction notes
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