반응식
[CH2:30]([Cl:31])[Cl:32].[c:17]1([CH3:29])[c:18]([N:23]2[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]2)[cH:19][cH:20][cH:21][cH:22]1.[c:1]1([C:7]2=[N:8][O:9][CH:10]([CH2:12][CH2:13][CH2:14][CH:15]=[O:16])[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([C:7]2=[N:8][O:9][CH:10]([CH2:12][CH2:13][CH2:14][CH2:15][N:26]3[CH2:25][CH2:24][N:23]([c:18]4[c:17]([CH3:29])[cH:22][cH:21][cH:20][cH:19]4)[CH2:28][CH2:27]3)[CH2:11]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-808b14542a474d3ab1f8cc7012965246
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…