[4-Methoxy-3-(4,4,5,5-tetramethyl-[1,3,2]dioxaborolan-2-yl)-phenyl]-acetic acid ethyl ester → {4'-Bromo-2'-[(tert-butoxycarbonyl-ethyl-amino)-methyl]-6-methoxy-biphenyl-3-yl}-acetic acid ethyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH3:9])[CH2:10][c:11]1[c:12]([I:18])[cH:13][cH:14][c:15]([Br:17])[cH:16]1)=[O:19].[CH2:20]([CH3:21])[O:22][C:23]([CH2:24][c:25]1[cH:26][c:27]([B:33]2[O:34][C:35]([CH3:36])([CH3:37])[C:38]([CH3:39])([CH3:40])[O:41]2)[c:28]([O:31][CH3:32])[cH:29][cH:30]1)=[O:42]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([N:7]([CH2:8][CH3:9])[CH2:10][c:11]1[c:12](-[c:27]2[cH:26][c:25]([CH2:24][C:23]([O:22][CH2:20][CH3:21])=[O:42])[cH:30][cH:29][c:28]2[O:31][CH3:32])[cH:13][cH:14][c:15]([Br:17])[cH:16]1)=[O:19]참가 물질
3
출처 및 근거
- ORD 기록
- ord-a78a4e1c0efd42c0ac2662baf1838c60
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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