Methanol → 3-Fluoro-4-[3-oxo-3-(2-phenylamino-pyridin-3-yl)-propyl]-benzoic acid methyl ester
반응식
[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([F:27])[c:7]([CH:10]=[CH:11][C:12]([c:13]2[c:14]([NH:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:15][cH:16][cH:17][cH:18]2)=[O:26])[cH:8][cH:9]1)=[O:28].[CH3:31][OH:32].[CH3:33][CH2:34][O:35][C:36](=[O:37])[CH3:38].[H:29][H:30].[Pt:39](=[O:40])=[O:41]>>[CH3:1][O:2][C:3]([c:4]1[cH:5][c:6]([F:27])[c:7]([CH2:10][CH2:11][C:12]([c:13]2[c:14]([NH:19][c:20]3[cH:21][cH:22][cH:23][cH:24][cH:25]3)[n:15][cH:16][cH:17][cH:18]2)=[O:26])[cH:8][cH:9]1)=[O:28]참가 물질
6
출처 및 근거
- ORD 기록
- ord-e10ab94ab5dc46d8aeda37d3b6fc510c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
반응 노트
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