반응식
[CH3:20][O:21][C:22]([CH:23]([NH2:24])[CH:25]([OH:26])[CH3:27])=[O:28].[CH3:33][OH:34].[Cl:29][CH:30]([Cl:31])[Cl:32].[ClH:19].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:10][C:11](=[O:12])[NH:13][CH:14]([CH3:15])[C:16](=[O:17])[OH:18])[cH:7][cH:8][cH:9]1>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([CH2:10][C:11](=[O:12])[NH:13][CH:14]([CH3:15])[C:16](=[O:18])[NH:24][CH:23]([C:22]([O:21][CH3:20])=[O:28])[CH:25]([OH:26])[CH3:27])[cH:7][cH:8][cH:9]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-f702ee0331bc4dd799210c77d643d704
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
연결된 노트
불러오는 중…