반응식
[B-:16]([F:17])([F:18])([F:19])[F:20].[CH2:38]([N:39]([CH:40]([CH3:41])[CH3:42])[CH:43]([CH3:44])[CH3:45])[CH3:46].[CH3:1][C:2]1([CH3:15])[CH:3]2[CH:4]1[CH2:5][c:6]1[c:7]([C:12](=[O:13])[OH:14])[s:8][c:9]([CH3:11])[c:10]12.[CH:62]([OH:63])=[O:64].[ClH:47].[NH2:48][CH2:49][c:50]1[cH:51][cH:52][c:53]([OH:56])[cH:54][cH:55]1.[O:57]=[CH:58][N:59]([CH3:60])[CH3:61].[n:21]1([O:22][C:23]([N:24]([CH3:25])[CH3:26])=[N+:27]([CH3:28])[CH3:29])[c:30]2[cH:31][cH:32][cH:33][cH:34][c:35]2[n:36][n:37]1>>[CH3:1][C:2]1([CH3:15])[CH:3]2[CH:4]1[CH2:5][c:6]1[c:7]([C:12](=[O:14])[NH:48][CH2:49][c:50]3[cH:51][cH:52][c:53]([OH:56])[cH:54][cH:55]3)[s:8][c:9]([CH3:11])[c:10]12참가 물질
9
반응물 8
생성물 1
출처 및 근거
- ORD 기록
- ord-f82c3305f0694926b82a2f3455d8d3dc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…