반응식
[C:1]([CH:2]([CH3:3])[CH3:4])(=[O:5])[c:6]1[cH:7][n:8][c:9]2[c:10]([O:17][CH3:18])[cH:11][cH:12][cH:13][c:14]2[c:15]1[Cl:16].[CH3:19][c:20]1[cH:21][c:22]([OH:23])[cH:24][cH:25][c:26]1[NH2:27].[O:28]1[CH2:29][CH2:30][O:31][CH2:32][CH2:33]1>>[C:1]([CH:2]([CH3:3])[CH3:4])(=[O:5])[c:6]1[cH:7][n:8][c:9]2[c:10]([O:17][CH3:18])[cH:11][cH:12][cH:13][c:14]2[c:15]1[NH:27][c:26]1[c:20]([CH3:19])[cH:21][c:22]([OH:23])[cH:24][cH:25]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-53ecdcb61c384562bc8868b4c568d964
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…