{1-[4-(6-Fluoro-4-oxo-2-phenyl-4H-chromen-3-yl)-phenyl]-cyclobutyl}-carbamic acid tert-butyl ester → (1-[4-(7,8-dimethoxy-4-oxo-2-phenyl-4H-chromen-3-yl)-phenyl]-cyclobutyl]-carbamic acid tert-butyl ester
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1([c:12]2[cH:13][cH:14][c:15](-[c:18]3[c:19](=[O:20])[c:21]4[c:22]([cH:23][cH:24][c:25]([F:26])[cH:27]4)[o:28][c:29]3-[c:30]3[cH:31][cH:32][cH:33][cH:34][cH:35]3)[cH:16][cH:17]2)[CH2:9][CH2:10][CH2:11]1)=[O:36].[I:37][c:38]1[c:39](-[c:53]2[cH:54][cH:55][cH:56][cH:57][cH:58]2)[o:40][c:41]2[c:42]([O:51][CH3:52])[c:43]([O:49][CH3:50])[cH:44][cH:45][c:46]2[c:47]1=[O:48]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6]([NH:7][C:8]1([c:12]2[cH:13][cH:14][c:15](-[c:38]3[c:39](-[c:53]4[cH:54][cH:55][cH:56][cH:57][cH:58]4)[o:40][c:41]4[c:42]([O:51][CH3:52])[c:43]([O:49][CH3:50])[cH:44][cH:45][c:46]4[c:47]3=[O:48])[cH:16][cH:17]2)[CH2:9][CH2:10][CH2:11]1)=[O:36]참가 물질
3
출처 및 근거
- ORD 기록
- ord-855944f40ab34b07a7c00b1f0ca2f6f0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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