반응식
[CH3:20][c:21]1[c:22]([B:26]([OH:27])[OH:28])[cH:23][s:24][cH:25]1.[Cl:1][c:2]1[n:3][c:4]([NH:14][c:15]2[n:16][nH:17][cH:18][cH:19]2)[cH:5][c:6]2[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12>>[c:2]1(-[c:22]2[c:21]([CH3:20])[cH:25][s:24][cH:23]2)[n:3][c:4]([NH:14][c:15]2[n:16][nH:17][cH:18][cH:19]2)[cH:5][c:6]2[cH:7][c:8]([O:12][CH3:13])[cH:9][cH:10][c:11]12참가 물질
3
출처 및 근거
- ORD 기록
- ord-ed04f66a220c46ce8f016f6d54c77663
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…