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[C:15](=[O:16])([O-:17])[O-:18].[CH3:39][C:40]#[N:41].[Cl:1][c:2]1[n:3][c:4](-[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:5][c:6]([Cl:8])[cH:7]1.[Cs+:19].[Cs+:20].[OH2:38].[OH:21][c:22]1[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][c:29]1[O:30][CH2:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1>>[c:2]1([O:21][c:22]2[cH:23][c:24]([C:25]#[N:26])[cH:27][cH:28][c:29]2[O:30][CH2:31][c:32]2[cH:33][cH:34][cH:35][cH:36][cH:37]2)[n:3][c:4](-[c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)[n:5][c:6]([Cl:8])[cH:7]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-1e66bb14b8df4e0492677f62edea003d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…