반응식
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][c:11]([Cl:33])[c:12]([O:16][CH2:17][CH2:18][CH2:19][NH:20][C:21]([c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)=[O:32])[c:13]([Cl:15])[cH:14]1.[CH3:36][CH2:37][O:38][C:39](=[O:40])[CH3:41].[H:34][H:35]>>[OH:8][c:9]1[cH:10][c:11]([Cl:33])[c:12]([O:16][CH2:17][CH2:18][CH2:19][NH:20][C:21]([c:22]2[cH:23][cH:24][c:25]([C:28]([F:29])([F:30])[F:31])[cH:26][cH:27]2)=[O:32])[c:13]([Cl:15])[cH:14]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-96406ab61c20419e8be92e968b88328d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…