반응식
[CH2:28]([CH2:29][O:30][CH3:31])[O:32][CH3:33].[Cs+:27].[F-:26].[F:13][c:14]1[c:15]([B:23]([OH:24])[OH:25])[cH:16][cH:17][c:18]([CH3:22])[c:19]1[O:20][CH3:21].[NH2:1][c:2]1[cH:3][c:4]([Cl:5])[n:6][c:7]([C:8]([OH:9])=[O:10])[c:11]1[Cl:12].[OH2:34]>>[NH2:1][c:2]1[cH:3][c:4](-[c:15]2[c:14]([F:13])[c:19]([O:20][CH3:21])[c:18]([CH3:22])[cH:17][cH:16]2)[n:6][c:7]([C:8]([OH:9])=[O:10])[c:11]1[Cl:12]참가 물질
7
출처 및 근거
- ORD 기록
- ord-149d2e0d912e4452b16e1217321c3153
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…