반응식
[CH2:17]([CH3:18])[O:19][C:20]([CH2:21][c:22]1[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]1)=[O:29].[CH3:2][O:3][S:4]([O-:5])(=[O:6])=[O:7].[CH3:30][CH2:31][OH:32].[CH3:8][N:9]([C:10]1=[N+:11]([CH3:15])[CH2:12][CH2:13][CH2:14]1)[CH3:16].[Na:1]>>[C:10]1(=[C:21]([C:20]([O:19][CH2:17][CH3:18])=[O:29])[c:22]2[cH:23][cH:24][c:25]([Cl:28])[cH:26][cH:27]2)[N:11]([CH3:15])[CH2:12][CH2:13][CH2:14]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-4f4de78a8cdd49b4970dee89b77478ca
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…