Acetic Acid → 4-Oxo-4-(2-phenylpropylamino)but-2-enoic acid
반응식
[CH3:18][C:19](=[O:20])[OH:21].[O:1]=[C:2]1[O:3][C:4](=[O:5])[CH:6]=[CH:7]1.[c:8]1([CH:14]([CH2:15][NH2:16])[CH3:17])[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[O:1]=[C:2]([CH:7]=[CH:6][C:4]([OH:3])=[O:5])[NH:16][CH2:15][CH:14]([c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1)[CH3:17]참가 물질
4
출처 및 근거
- ORD 기록
- ord-776e432aac8440389b1359e16bb29c75
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
반응 노트
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