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[CH2:49]([Cl:50])[Cl:51].[CH3:23][O:24][C:25]([c:26]1[cH:27][cH:28][c:29]([CH2:32][n:33]2[n:34][c:35]([NH2:38])[cH:36][cH:37]2)[cH:30][cH:31]1)=[O:39].[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[Cl:1][c:2]1[cH:3][c:4]([C:12]([C:13](=[O:14])[OH:15])=[N:16][O:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]>>[Cl:1][c:2]1[cH:3][c:4]([C:12]([C:13](=[O:15])[NH:38][c:35]2[n:34][n:33]([CH2:32][c:29]3[cH:28][cH:27][c:26]([C:25]([O:24][CH3:23])=[O:39])[cH:31][cH:30]3)[cH:37][cH:36]2)=[N:16][O:17][CH:18]2[CH2:19][CH2:20][CH2:21][CH2:22]2)[cH:5][cH:6][c:7]1[S:8](=[O:9])(=[O:10])[CH3:11]참가 물질
5
출처 및 근거
- ORD 기록
- ord-164b92a047c341a9a5591830a05c977c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…