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[Br:15][CH:16]=[C:17]1[c:18]2[c:19]([cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]2)[CH2:20][CH2:21][c:22]2[c:23]1[cH:24][cH:25][c:26]([O:28][CH3:29])[cH:27]2.[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[cH:7][c:8]([B:12]([OH:13])[OH:14])[cH:9][cH:10][cH:11]1>>[CH3:1][S:2](=[O:3])(=[O:4])[NH:5][c:6]1[cH:7][c:8]([CH:16]=[C:17]2[c:18]3[c:19]([cH:30][c:31]([O:34][CH3:35])[cH:32][cH:33]3)[CH2:20][CH2:21][c:22]3[c:23]2[cH:24][cH:25][c:26]([O:28][CH3:29])[cH:27]3)[cH:9][cH:10][cH:11]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-00945179de934466a24ec3b215d54496
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…