Chloride → Hippuric Acid
Reaction equation
[C:1]([CH2:2][NH:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)(=[O:12])[NH:13][CH:14]([C:15]([NH:16][CH:17]([C:18]([OH:19])=[O:20])[CH2:21][CH:22]([CH3:23])[CH3:24])=[O:25])[CH2:26][c:27]1[n:28][cH:29][nH:30][cH:31]1.[Cl-:37].[ClH:32].[Na+:38].[O-:33][B:34]([O-:35])[O-:36].[OH2:45].[OH:39][CH2:40][CH:41]([CH2:42][OH:43])[OH:44]>>[C:1]([CH2:2][NH:3][C:4](=[O:5])[c:6]1[cH:7][cH:8][cH:9][cH:10][cH:11]1)([OH:12])=[O:33]Participants
8
Sources & evidence
- ORD record
- ord-7d0e8a3ff82241079cb83fd5d60f1b0c
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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