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[CH3:1][O:2][c:3]1[c:4]([S:11][c:12]2[nH:13][c:14]3[n:15][cH:16][n:17][c:18]([NH2:21])[c:19]3[n:20]2)[cH:5][c:6]([O:9][CH3:10])[cH:7][cH:8]1.[Cl:22][CH2:23][CH:24]([OH:25])[c:26]1[c:27]([Cl:33])[cH:28][c:29]([Cl:32])[cH:30][cH:31]1>>[CH3:1][O:2][c:3]1[c:4]([S:11][c:12]2[n:13]([CH2:23][CH:24]([OH:25])[c:26]3[c:27]([Cl:33])[cH:28][c:29]([Cl:32])[cH:30][cH:31]3)[c:14]3[n:15][cH:16][n:17][c:18]([NH2:21])[c:19]3[n:20]2)[cH:5][c:6]([O:9][CH3:10])[cH:7][cH:8]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-645506bac2e04bd1b27d5f01fcc94215
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
연결된 노트
불러오는 중…