Bicarbonate Ion → Crisaborole intermediate
Reaction equation
[BH3:33].[CH2:39]1[O:40][CH2:41][CH2:42][CH2:43]1.[CH3:21][O:22][B:23]([O:24][CH3:25])[O:26][CH3:27].[CH3:44][CH2:45][O:46][C:47]([CH3:48])=[O:49].[CH3:50][OH:51].[Na+:38].[O-:34][C:35]([OH:36])=[O:37].[O:28]1[CH2:29][CH2:30][CH2:31][CH2:32]1.[OH:1][B:2]1[O:3][CH2:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([O:11][c:12]1[cH:13][cH:14][c:15]([C:16](=[O:17])[OH:18])[cH:19][cH:20]1)[cH:10]2>>[OH:1][B:2]1[O:3][CH2:4][c:5]2[c:6]1[cH:7][cH:8][c:9]([O:11][c:12]1[cH:13][cH:14][c:15]([CH2:16][OH:17])[cH:19][cH:20]1)[cH:10]2Participants
9
Sources & evidence
- ORD record
- ord-5cd0d7dab9ec4f2baacd12cdb2a23e6b
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
Reaction notes
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