반응식
[CH3:1][C:2]1([CH3:4])[O:3][c:21]2[c:13]([cH:14][c:15]([C:16]([NH2:17])=[O:18])[cH:19][cH:20]2)[CH:6]([c:7]2[cH:8][cH:9][cH:10][cH:11][n:12]2)[CH2:5]1.[Cl:43][c:44]1[cH:45][cH:46][cH:47][c:48]([C:49]([O:50][OH:51])=[O:52])[cH:53]1.[Cl:54][CH2:55][Cl:56].[OH:22][CH:23]([C:24]([O:25][c:26]1[cH:27][cH:28][c:29]([C:30]#[N:31])[cH:32][cH:33]1)([CH3:34])[CH3:35])[CH2:36][c:37]1[n:38][cH:39][n:40][cH:41][cH:42]1>>[O-:3][n+:38]1[c:37]([CH2:36][CH:23]([OH:22])[C:24]([O:25][c:26]2[cH:27][cH:28][c:29]([C:30]#[N:31])[cH:32][cH:33]2)([CH3:34])[CH3:35])[cH:42][cH:41][n:40][cH:39]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-1866729f0c634e738ada84f060174b4d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
연결된 노트
불러오는 중…