반응식
[CH3:18][c:19]1[c:20]([N+:21]([O-:22])=[O:23])[cH:24][cH:25][c:26]([CH3:27])[c:28]1[CH2:29][Cl:30].[CH3:1][S:2](=[O:3])(=[O:4])[O:5][CH2:6][c:7]1[c:8]([CH3:17])[c:9]([N+:14](=[O:15])[O-:16])[cH:10][cH:11][c:12]1[CH3:13].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[H-:31].[Na+:32].[OH2:50].[OH:33][c:34]1[cH:35][cH:36][cH:37][c:38]2[cH:39][cH:40][c:41]([CH3:44])[n:42][c:43]12>>[O:5]([CH2:6][c:7]1[c:8]([CH3:17])[c:9]([N+:14](=[O:15])[O-:16])[cH:10][cH:11][c:12]1[CH3:13])[c:34]1[cH:35][cH:36][cH:37][c:38]2[cH:39][cH:40][c:41]([CH3:44])[n:42][c:43]12참가 물질
8
출처 및 근거
- ORD 기록
- ord-cdd3c09b7ccc4640b04dfee000629eb3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…