반응식
[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:17][cH:18]1)-[c:6]1[n:7][c:8]([C:14]([OH:15])=[O:16])[s:9][c:10]1[CH2:11][CH2:12][O:13]2.[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[c:26]1([P:27]([N:28]=[N+:29]=[N-:30])([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)=[O:37])[cH:38][cH:39][cH:40][cH:41][cH:42]1>>[Br:1][c:2]1[cH:3][c:4]2[c:5]([cH:17][cH:18]1)-[c:6]1[n:7][c:8]([NH2:21])[s:9][c:10]1[CH2:11][CH2:12][O:13]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-4e1397d7e5ef4e52a46aeae3eb8622cb
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…