Acetate → 4-((4-chlorophenoxy)methyl)-1-(4-(2-hydroxy-2-methylpropoxy)-3-methoxyphenyl)pyrimidin-2(1H)-one
반응식
[C:38]([O-:39])(=[O:40])[CH3:41].[C:43]([O-:44])(=[O:45])[CH3:46].[CH3:34][OH:35].[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][c:8]2[n:9][c:10](=[O:14])[nH:11][cH:12][cH:13]2)[cH:15][cH:16]1.[Cu+2:42].[OH2:36].[OH2:37].[OH:17][C:18]([CH2:19][O:20][c:21]1[c:22]([O:30][CH3:31])[cH:23][c:24]([B:27]([OH:28])[OH:29])[cH:25][cH:26]1)([CH3:32])[CH3:33]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][c:8]2[n:9][c:10](=[O:14])[n:11](-[c:24]3[cH:23][c:22]([O:30][CH3:31])[c:21]([O:20][CH2:19][C:18]([OH:17])([CH3:32])[CH3:33])[cH:26][cH:25]3)[cH:12][cH:13]2)[cH:15][cH:16]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-cbcac62728304f5192fafe0d7b4a1c1e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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