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[Br:20][CH2:21][C:22](=[O:23])[c:24]1[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH3:33])[cH:34][cH:35]1.[CH3:13][CH2:14][N:15]([CH2:16][CH3:17])[CH2:18][CH3:19].[CH3:36][C:37]#[N:38].[N:1]1([c:7]2[n:8][cH:9][n:10][cH:11][cH:12]2)[CH2:2][CH2:3][NH:4][CH2:5][CH2:6]1>>[N:1]1([c:7]2[n:8][cH:9][n:10][cH:11][cH:12]2)[CH2:2][CH2:3][N:4]([CH2:21][C:22](=[O:23])[c:24]2[cH:25][cH:26][c:27]([O:28][CH2:29][C:30](=[O:31])[O:32][CH3:33])[cH:34][cH:35]2)[CH2:5][CH2:6]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-fe8a30f4a80a4799b925d2baa87893d3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…