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[Br:15][c:16]1[c:17]([C:28]#[N:29])[n:18][n:19]([CH2:26][CH3:27])[c:20]1[CH2:21][CH2:22][CH2:23][CH2:24][Cl:25].[C:1]1(=[O:11])[c:2]2[c:3]([cH:7][cH:8][cH:9][cH:10]2)[C:4](=[O:6])[NH:5]1.[CH:30]([Cl:31])([Cl:32])[Cl:33].[I-:14].[K:12].[Na+:13].[O:35]=[CH:36][N:37]([CH3:38])[CH3:39].[OH2:34]>>[C:1]1(=[O:11])[c:2]2[c:3]([cH:7][cH:8][cH:9][cH:10]2)[C:4](=[O:6])[N:5]1[CH2:24][CH2:23][CH2:22][CH2:21][c:20]1[c:16]([Br:15])[c:17]([C:28]#[N:29])[n:18][n:19]1[CH2:26][CH3:27]참가 물질
9
출처 및 근거
- ORD 기록
- ord-eb6f6cfeea604215bdcb919c0eba6c86
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…