HCID 59612882, 화합물 → HCID 59619622, 화합물
반응식
[Br:1][c:2]1[cH:3][c:4]2[c:5]3[c:6]([cH:7][n:8][c:9]2[cH:10][cH:11]1)[n:12]([CH3:23])[c:13](=[O:22])[n:14]3-[c:15]1[c:16]([CH3:21])[n:17][n:18]([CH3:20])[cH:19]1.[CH2:24]([CH3:25])[NH:26][c:27]1[c:28]([CH3:42])[n:29][cH:30][c:31]([B:33]2[O:34][C:35]([CH3:36])([CH3:37])[C:38]([CH3:39])([CH3:40])[O:41]2)[cH:32]1>>[c:2]1(-[c:31]2[cH:30][n:29][c:28]([CH3:42])[c:27]([NH:26][CH2:24][CH3:25])[cH:32]2)[cH:3][c:4]2[c:5]3[c:6]([cH:7][n:8][c:9]2[cH:10][cH:11]1)[n:12]([CH3:23])[c:13](=[O:22])[n:14]3-[c:15]1[c:16]([CH3:21])[n:17][n:18]([CH3:20])[cH:19]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-84d49f53f8724d879bb3382315c46422
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
불러오는 중…