반응식
[C:35]([O:36][BH-:37]([O:38][C:39](=[O:40])[CH3:41])[O:42][C:43](=[O:44])[CH3:45])(=[O:46])[CH3:47].[CH3:18][CH:19]([CH2:20][c:21]1[cH:22][cH:23][cH:24][cH:25][cH:26]1)[NH2:27].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH:7]=[O:8])[cH:9][c:10]1[O:11][CH3:12].[CH3:28][CH2:29][N:30]([CH2:31][CH3:32])[CH2:33][CH3:34].[Cl:49][CH2:50][CH2:51][Cl:52].[Na+:48].[S:13]([OH:14])([OH:15])(=[O:16])=[O:17]>>[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][NH:27][CH:19]([CH3:18])[CH2:20][c:21]2[cH:22][cH:23][cH:24][cH:25][cH:26]2)[cH:9][c:10]1[O:11][CH3:12]참가 물질
8
출처 및 근거
- ORD 기록
- ord-71c76f37261743f8863908512c4cd830
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…