Sodium ion → Ethyl 3-oxo-3-(4-pyridyl)-2-((4-(trifluoromethyl)phenyl)methyl)propionate
반응식
[CH3:30][O:31][CH2:32][CH2:33][O:34][CH3:35].[F:17][C:18]([c:19]1[cH:20][cH:21][c:22]([CH2:23][Br:24])[cH:25][cH:26]1)([F:27])[F:28].[H-:15].[Na+:16].[O:1]=[C:2]([CH2:3][C:4](=[O:5])[O:6][CH2:7][CH3:8])[c:9]1[cH:10][cH:11][n:12][cH:13][cH:14]1.[OH2:29]>>[O:1]=[C:2]([CH:3]([C:4](=[O:5])[O:6][CH2:7][CH3:8])[CH2:23][c:22]1[cH:21][cH:20][c:19]([C:18]([F:17])([F:27])[F:28])[cH:26][cH:25]1)[c:9]1[cH:10][cH:11][n:12][cH:13][cH:14]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-98fc10d94a69411ab87eb0acac64a052
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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