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[Br:23][N:24]1[C:25](=[O:26])[CH2:27][CH2:28][C:29]1=[O:30].[CH3:56][CH2:57][O:58][C:59](=[O:60])[CH3:61].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][cH:10][c:11]3[cH:12][c:13]([CH3:17])[cH:14][n:15][c:16]23)[c:18]([Cl:22])[cH:19][cH:20][cH:21]1.[Cl:53][CH2:54][Cl:55].[N:31]([C:32]([CH3:33])([CH2:34][C:35]([CH3:36])([O:37][CH3:38])[CH3:39])[C:40]#[N:41])=[N:42][C:43]([CH3:44])([CH2:45][C:46]([O:47][CH3:48])([CH3:49])[CH3:50])[C:51]#[N:52]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][c:7]2[cH:8][cH:9][c:10]([Br:23])[c:11]3[cH:12][c:13]([CH3:17])[cH:14][n:15][c:16]23)[c:18]([Cl:22])[cH:19][cH:20][cH:21]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-118d9c2e6d1749b2b62b00d0f7548db5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…