Citric Acid → 4-(2-Bromo-5-fluorophenyl)-2-hydroxy-4-methylvaleric acid-methyl ester
Reaction equation
[C:26]([O-:27])(=[O:28])[O-:29].[C:37](=[O:38])([O-:39])[O-:40].[CH3:1][O:2][C:3]([CH:4]([CH2:5][C:6]([CH3:7])([CH3:8])[c:9]1[c:10]([Br:16])[cH:11][cH:12][c:13]([F:15])[cH:14]1)[C:17](=[O:18])[c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)=[O:25].[CH3:43][I:44].[CH3:58][OH:59].[Cs+:41].[Cs+:42].[K+:30].[K+:31].[OH:45][C:46]([CH2:47][C:48]([C:49](=[O:50])[OH:51])([CH2:52][C:53](=[O:54])[OH:55])[OH:56])=[O:57].[S:32](=[O:33])(=[O:34])([OH:35])[OH:36]>>[CH3:1][O:2][C:3]([CH:4]([CH2:5][C:6]([CH3:7])([CH3:8])[c:9]1[c:10]([Br:16])[cH:11][cH:12][c:13]([F:15])[cH:14]1)[OH:27])=[O:25]Participants
9
Reactant 8
Product 1
Sources & evidence
- ORD record
- ord-efa1146028c54f72a3209474a759f580
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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