반응식
[C:37]([O:38][CH3:39])([CH3:40])([CH3:41])[CH3:42].[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[Cl:3][c:4]1[n:5][c:6]([S:20][CH3:21])[n:7][c:8](-[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][cH:15]2)[cH:9]1.[H-:1].[Na+:2].[OH2:31].[OH:22][CH2:23][CH2:24][N:25]1[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]1>>[c:4]1([O:22][CH2:23][CH2:24][N:25]2[CH2:26][CH2:27][CH2:28][CH2:29][CH2:30]2)[n:5][c:6]([S:20][CH3:21])[n:7][c:8](-[c:10]2[cH:11][c:12]([C:16]([F:17])([F:18])[F:19])[cH:13][cH:14][cH:15]2)[cH:9]1참가 물질
8
출처 및 근거
- ORD 기록
- ord-d9ebd736af5c4de7b00408f3cd96fb63
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…