반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([OH:11])[cH:8][cH:9][cH:10]1.[CH3:12][CH2:13][N:14]([CH2:15][CH3:16])[CH2:17][CH3:18].[CH3:19][S:20]([Cl:21])(=[O:22])=[O:23].[CH3:24][c:25]1[cH:26][cH:27][cH:28][cH:29][cH:30]1.[OH2:31]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[c:5]1[cH:6][c:7]([O:11][S:20]([CH3:19])(=[O:22])=[O:23])[cH:8][cH:9][cH:10]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-34e21489e8334ebd8a3de33065ecd441
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…