반응식
[C:14]([CH3:15])(=[O:16])[NH:17][c:18]1[cH:19][cH:20][c:21]([OH:24])[cH:22][cH:23]1.[C:25](=[O:26])([O-:27])[O-:28].[Cl:2][CH2:3][c:4]1[n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13]1.[ClH:1].[K+:29].[K+:30].[O:31]=[CH:32][N:33]([CH3:34])[CH3:35]>>[CH2:3]([c:4]1[n:5][c:6]2[cH:7][cH:8][cH:9][cH:10][c:11]2[cH:12][cH:13]1)[O:24][c:21]1[cH:20][cH:19][c:18]([NH:17][C:14]([CH3:15])=[O:16])[cH:23][cH:22]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-851a917a56ae4227b47843268554640f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
연결된 노트
불러오는 중…