반응식
[CH2:17]([CH3:18])[c:19]1[cH:20][c:21]([NH2:22])[cH:23][cH:24][cH:25]1.[CH3:12][S:13](=[O:14])(=[O:15])[OH:16].[Cl:1][c:2]1[c:3]([NH:9][C:10]#[N:11])[cH:4][c:5]([Cl:8])[cH:6][cH:7]1.[Cl:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1>>[CH3:12][S:13](=[O:14])(=[O:15])[OH:16].[Cl:1][c:2]1[c:3]([NH:9][C:10](=[NH:11])[NH:22][c:21]2[cH:20][c:19]([CH2:17][CH3:18])[cH:25][cH:24][cH:23]2)[cH:4][c:5]([Cl:8])[cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-e4f83089d4c44f9b88518736bd361c5f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…