Bicarbonate Ion → 1-(4'-{3-Methyl-4-[6-(2-methyl-phenyl)-pyridin-2-ylamino]-isoxazol-5-yl}-biphenyl-4-yl)-cyclopropanecarboxylic acid ethyl ester
Reaction equation
[C:45](=[O:46])([OH:47])[O-:48].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][cH:17][c:18](-[c:21]4[c:22]([NH:27][c:28]5[n:29][c:30]([Br:34])[cH:31][cH:32][cH:33]5)[c:23]([CH3:26])[n:24][o:25]4)[cH:19][cH:20]3)[cH:13][cH:14]2)[CH2:7][CH2:8]1.[CH3:51][CH2:52][O:53][C:54]([CH3:55])=[O:56].[Na+:49].[OH2:50].[c:35]1([CH3:44])[c:36]([B:41]([OH:42])[OH:43])[cH:37][cH:38][cH:39][cH:40]1>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[C:6]1([c:9]2[cH:10][cH:11][c:12](-[c:15]3[cH:16][cH:17][c:18](-[c:21]4[c:22]([NH:27][c:28]5[n:29][c:30](-[c:36]6[c:35]([CH3:44])[cH:40][cH:39][cH:38][cH:37]6)[cH:31][cH:32][cH:33]5)[c:23]([CH3:26])[n:24][o:25]4)[cH:19][cH:20]3)[cH:13][cH:14]2)[CH2:7][CH2:8]1Participants
7
Reactant 6
Product 1
Sources & evidence
- ORD record
- ord-189703cf72c94e0ca941e78c96252577
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
Reaction notes
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