반응식
[CH3:14][C:15](=[O:16])[OH:17].[CH3:18][S:19][c:20]1[n:21][c:22]([OH:29])[c:23]2[c:24]([n:25]1)[CH2:26][CH2:27][S:28]2.[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][NH:11][CH2:12][CH2:13]2)[cH:6][cH:7]1.[OH2:30]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][N:11]([c:20]3[n:21][c:22]([OH:29])[c:23]4[c:24]([n:25]3)[CH2:26][CH2:27][S:28]4)[CH2:12][CH2:13]2)[cH:6][cH:7]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-5a636cf6c94a4adcbf707420ec3a412a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…