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[CH3:19][C:20]([O:21][C:22](=[O:23])[CH3:24])=[O:25].[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([N+:13](=[O:14])[O-:15])[cH:8][c:9]2[c:10]1[CH:11]=[O:12].[CH:26]([OH:27])=[O:28].[ClH:16].[NH2:17][OH:18].[O:29]=[CH:30][N:31]([CH3:32])[CH3:33].[OH2:34]>>[CH3:1][c:2]1[nH:3][c:4]2[cH:5][cH:6][c:7]([N+:13](=[O:14])[O-:15])[cH:8][c:9]2[c:10]1[C:11]#[N:17]참가 물질
8
출처 및 근거
- ORD 기록
- ord-273d5cbd25024dd193c61fa0e7d69d84
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
연결된 노트
불러오는 중…