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[C:20](=[O:21])([O-:22])[O-:23].[Cl:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([CH:14]3[CH:15]([CH2:17][CH2:18][NH2:19])[CH2:16]3)[CH2:12][CH2:13]2)[n:6][cH:7]1.[Cl:26][c:27]1[cH:28][c:29]([C:34]#[N:35])[n:30][c:31]([CH3:33])[n:32]1.[Cs+:24].[Cs+:25].[O:36]=[CH:37][N:38]([CH3:39])[CH3:40]>>[Cl:1][c:2]1[cH:3][n:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([CH:14]3[CH:15]([CH2:17][CH2:18][NH:19][c:27]4[cH:28][c:29]([C:34]#[N:35])[n:30][c:31]([CH3:33])[n:32]4)[CH2:16]3)[CH2:12][CH2:13]2)[n:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-1c5d47ff76164245a5d6a62658053bb4
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…