반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([Cl:19])[n:14][cH:15][n:16][c:17]2[cH:18]1.[CH3:39][CH2:40][CH2:41][CH2:42][N+:43]([CH2:44][CH2:45][CH2:46][CH3:47])([CH2:48][CH2:49][CH2:50][CH3:51])[CH2:52][CH2:53][CH2:54][CH3:55].[CH3:56][C:57](=[O:58])[CH3:59].[CH:34]([Cl:35])([Cl:36])[Cl:37].[Cl-:38].[ClH:22].[NH2:23][c:24]1[c:25]([Cl:31])[cH:26][c:27]([OH:30])[cH:28][cH:29]1.[Na+:33].[OH-:32].[OH2:60]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([O:20][CH3:21])[cH:11][c:12]2[c:13]([O:30][c:27]3[cH:26][c:25]([Cl:31])[c:24]([NH2:23])[cH:29][cH:28]3)[n:14][cH:15][n:16][c:17]2[cH:18]1참가 물질
11
반응물 10
생성물 1
출처 및 근거
- ORD 기록
- ord-5549290cfedf4b99a5b14e354e84587d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…