반응식
[CH3:41][O:42][c:43]1[cH:44][n:45][cH:46][c:47]([B:49]2[O:50][C:51]([CH3:52])([CH3:53])[C:54]([CH3:55])([CH3:56])[O:57]2)[cH:48]1.[CH3:58][C:59]#[N:60].[NH2:1][c:2]1[n:3][c:4]([O:27][CH:28]([C:29]([F:30])([F:31])[F:32])[c:33]2[c:34]([F:40])[cH:35][c:36]([Br:39])[cH:37][cH:38]2)[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([CH2:14][CH:15]([C:16](=[O:17])[OH:18])[NH:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:12][cH:13]2)[n:7]1.[Na+:61].[Na+:62].[O-:63][C:64](=[O:65])[O-:66].[OH2:67]>>[NH2:1][c:2]1[n:3][c:4]([O:27][CH:28]([C:29]([F:30])([F:31])[F:32])[c:33]2[c:34]([F:40])[cH:35][c:36](-[c:47]3[cH:46][n:45][cH:44][c:43]([O:42][CH3:41])[cH:48]3)[cH:37][cH:38]2)[cH:5][c:6](-[c:8]2[cH:9][cH:10][c:11]([CH2:14][CH:15]([C:16](=[O:17])[OH:18])[NH:19][C:20](=[O:21])[O:22][C:23]([CH3:24])([CH3:25])[CH3:26])[cH:12][cH:13]2)[n:7]1참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-f757c3b9d7c24f218b22d6c9544f7a58
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…