반응식
[C:37](=[O:38])([OH:39])[O-:40].[CH3:42][S:43]([CH3:44])=[O:45].[Cl:11][c:12]1[c:13]([NH:21][c:22]2[c:23]([C:35]#[N:36])[cH:24][n:25][c:26]3[cH:27][c:28]([F:34])[c:29]([O:32][CH3:33])[cH:30][c:31]23)[cH:14][c:15]([O:19][CH3:20])[c:16]([Cl:18])[cH:17]1.[H-:1].[Na+:2].[Na+:41].[OH:3][CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1>>[O:3]([CH2:4][c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[c:28]1[cH:27][c:26]2[n:25][cH:24][c:23]([C:35]#[N:36])[c:22]([NH:21][c:13]3[c:12]([Cl:11])[cH:17][c:16]([Cl:18])[c:15]([O:19][CH3:20])[cH:14]3)[c:31]2[cH:30][c:29]1[O:32][CH3:33]참가 물질
7
반응물 6
생성물 1
출처 및 근거
- ORD 기록
- ord-02c4765c86104bfca6198f0b3b6599e2
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…