Acetic Acid → HCID 178458324, compound
Reaction equation
[CH3:42][C:43](=[O:44])[OH:45].[CH3:46][N:47]1[CH2:48][CH2:49][CH2:50][C:51]1=[O:52].[CH3:58][CH2:59][O:60][C:61](=[O:62])[CH3:63].[CH:64]([O:65][CH:66]([CH3:67])[CH3:68])([CH3:69])[CH3:70].[F:1][C:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][c:8](-[n:11]2[c:12](=[O:16])[nH:13][cH:14][cH:15]2)[cH:9][cH:10]1)([CH:17]([F:18])[F:19])[F:20].[F:23][c:24]1[c:25]([C:30]([CH:31]([CH3:32])[O:33][S:34]([C:35]([F:36])([F:37])[F:38])(=[O:39])=[O:40])=[O:41])[cH:26][cH:27][cH:28][cH:29]1.[H-:21].[Na+:22].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1>>[F:1][C:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][c:8](-[n:11]2[c:12](=[O:16])[n:13]([CH:31]([C:30]([c:25]3[c:24]([F:23])[cH:29][cH:28][cH:27][cH:26]3)=[O:41])[CH3:32])[cH:14][cH:15]2)[cH:9][cH:10]1)([CH:17]([F:18])[F:19])[F:20]Participants
10
Sources & evidence
- ORD record
- ord-fe3b912492b54353bb7d4f20e30bcbd4
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
Reaction notes
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