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[NH2:1][c:2]1[c:3]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:4]([CH3:17])[n:5][c:6]2[cH:7][cH:8][cH:9][c:10]([O:12][CH2:13][CH:14]([CH3:15])[NH2:16])[c:11]12.[O:23]1[c:24]2[c:25]([c:29]([C:33](=[O:34])[OH:35])[cH:30][cH:31][cH:32]2)[O:26][CH2:27][CH2:28]1>>[NH2:1][c:2]1[c:3]([C:18](=[O:19])[O:20][CH2:21][CH3:22])[c:4]([CH3:17])[n:5][c:6]2[cH:7][cH:8][cH:9][c:10]([O:12][CH2:13][CH:14]([CH3:15])[NH:16][C:33]([c:29]3[c:25]4[c:24]([cH:32][cH:31][cH:30]3)[O:23][CH2:28][CH2:27][O:26]4)=[O:34])[c:11]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-a0b10c40c8a3437fae1226ac038367ff
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…