반응식
[C:15]([CH3:16])(=[O:17])[NH:18][c:19]1[cH:20][cH:21][c:22]([S:25](=[O:26])(=[O:27])[Cl:28])[cH:23][cH:24]1.[CH3:29][CH2:30][N:31]([CH2:32][CH3:33])[CH2:34][CH3:35].[CH3:36][CH2:37][OH:38].[CH3:6][NH:7][c:8]1[cH:9][cH:10][c:11]([OH:14])[cH:12][cH:13]1.[S:1]([OH:2])([OH:3])(=[O:4])=[O:5]>>[CH3:6][N:7]([c:8]1[cH:9][cH:10][c:11]([OH:14])[cH:12][cH:13]1)[S:25]([c:22]1[cH:21][cH:20][c:19]([NH:18][C:15]([CH3:16])=[O:17])[cH:24][cH:23]1)(=[O:26])=[O:27]참가 물질
6
출처 및 근거
- ORD 기록
- ord-87131c22e7c242d6897a47cbb393848e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…