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[CH3:22][O:23][c:24]1[cH:25][cH:26][c:27]([C:28](=[O:29])[Cl:30])[cH:31][cH:32]1.[n:1]1[cH:2][cH:3][c:4]([N:7]2[CH2:8][CH2:9][CH:10]([CH2:13][NH:14][c:15]3[n:16][cH:17][cH:18][cH:19][c:20]3[NH2:21])[CH2:11][CH2:12]2)[cH:5][cH:6]1>>[n:1]1[cH:2][cH:3][c:4]([N:7]2[CH2:8][CH2:9][CH:10]([CH2:13][NH:14][c:15]3[n:16][cH:17][cH:18][cH:19][c:20]3[NH:21][C:28]([c:27]3[cH:26][cH:25][c:24]([O:23][CH3:22])[cH:32][cH:31]3)=[O:29])[CH2:11][CH2:12]2)[cH:5][cH:6]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-b074594f151d4d6d9208752ccea370c0
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…