Ethanol → 3-[9-(5-{5-Chloro-6-[(1-methylethyl)oxy]-3-pyridinyl}-1,2,4-oxadiazol-3-yl)-2,3-dihydro-1,4-benzoxazepin-4(5H)-yl]propanoic acid
Reaction equation
[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[cH:18][cH:19][cH:20][c:21]4[c:27]3[O:26][CH2:25][CH2:24][N:23]([CH2:28][CH2:29][C:30](=[O:31])[O:32][CH2:33][CH3:34])[CH2:22]4)[n:15][o:16]2)[cH:5][n:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11].[Na+:36].[OH-:35]>>[Cl:1][c:2]1[cH:3][c:4](-[c:12]2[n:13][c:14](-[c:17]3[cH:18][cH:19][cH:20][c:21]4[c:27]3[O:26][CH2:25][CH2:24][N:23]([CH2:28][CH2:29][C:30](=[O:31])[OH:32])[CH2:22]4)[n:15][o:16]2)[cH:5][n:6][c:7]1[O:8][CH:9]([CH3:10])[CH3:11]Participants
5
Reactant 4
Product 1
Sources & evidence
- ORD record
- ord-88352b58c2c44cb1a886d172448e4458
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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