Ethanol → 3-Dimethylamino-1-(2'-methoxy-5'-acetamidophenyl)prop-2-en-1-one
반응식
[CH3:1][O:2][CH:3]([N:4]([CH3:5])[CH3:6])[O:7][CH3:8].[CH3:24][CH2:25][OH:26].[CH3:9][O:10][c:11]1[c:12]([C:21]([CH3:22])=[O:23])[cH:13][c:14]([NH:17][C:18]([CH3:19])=[O:20])[cH:15][cH:16]1>>[CH:3]([N:4]([CH3:5])[CH3:6])=[CH:22][C:21]([c:12]1[c:11]([O:10][CH3:9])[cH:16][cH:15][c:14]([NH:17][C:18]([CH3:19])=[O:20])[cH:13]1)=[O:23]참가 물질
4
출처 및 근거
- ORD 기록
- ord-e79ed8ea5582427d973529f72a974c49
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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