Methanol → 2-Fluoro-4-[1-hydroxy-3-(3-tritylimidazol-4-yl)prop-2-enyl]benzonitrile
반응식
[BH4-:38].[CH3:40][OH:41].[F:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([C:10]([CH:11]=[CH:12][c:13]2[cH:14][n:15][cH:16][n:17]2[C:18]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[cH:9]1.[Na+:39]>>[F:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][cH:7][c:8]([CH:10]([CH:11]=[CH:12][c:13]2[cH:14][n:15][cH:16][n:17]2[C:18]([c:19]2[cH:20][cH:21][cH:22][cH:23][cH:24]2)([c:25]2[cH:26][cH:27][cH:28][cH:29][cH:30]2)[c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[OH:37])[cH:9]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-6707d6748e4345fe85c8646d8ff5c95e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)