반응식
[Br:39][c:40]1[cH:41][cH:42][c:43]([OH:46])[cH:44][cH:45]1.[CH2:61]1[O:62][CH2:63][CH2:64][CH2:65]1.[Cl:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:19])[N:11]3[CH:12]([C:13]2=[O:14])[CH2:15][CH:16]([OH:18])[CH2:17]3)[cH:5][c:6]([Cl:8])[cH:7]1.[O:47]=[C:48]([O:49][CH:50]([CH3:51])[CH3:52])[N:53]=[N:54][C:55]([O:56][CH:57]([CH3:58])[CH3:59])=[O:60].[c:20]1([P:21]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[Cl:1][c:2]1[cH:3][c:4]([N:9]2[C:10](=[O:19])[N:11]3[CH:12]([C:13]2=[O:14])[CH2:15][CH:16]([O:18][c:43]2[cH:42][cH:41][c:40]([Br:39])[cH:45][cH:44]2)[CH2:17]3)[cH:5][c:6]([Cl:8])[cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-3c152c332f814d92918a13bd6203da34
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…