Serinol → N-(1,3-dihydroxypropan-2-yl)-4-methoxy-3-[2-[4-(trifluoromethoxy)phenyl]ethenyl]benzamide
반응식
[CH3:1][O:2][c:3]1[c:4]([CH:12]=[CH:13][c:14]2[cH:15][cH:16][c:17]([O:20][C:21]([F:22])([F:23])[F:24])[cH:18][cH:19]2)[cH:5][c:6]([C:7](=[O:8])[OH:9])[cH:10][cH:11]1.[NH2:25][CH:26]([CH2:27][OH:28])[CH2:29][OH:30]>>[CH3:1][O:2][c:3]1[c:4]([CH:12]=[CH:13][c:14]2[cH:15][cH:16][c:17]([O:20][C:21]([F:22])([F:23])[F:24])[cH:18][cH:19]2)[cH:5][c:6]([C:7](=[O:9])[NH:25][CH:26]([CH2:27][OH:28])[CH2:29][OH:30])[cH:10][cH:11]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-e4f29cc040d14fff8703ab22e710e57f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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