반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][CH2:6][C:7](=[O:8])[c:9]1[cH:10][c:11]([OH:24])[c:12]([O:15][C:16]([c:17]2[cH:18][n:19][cH:20][cH:21][cH:22]2)=[O:23])[cH:13][cH:14]1.[C:36]([CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH:44]=[CH:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53])(=[O:54])[Cl:55].[CH3:25][O-:26].[Na+:27].[Na+:28].[O-:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[NH:5][CH2:6][C:7](=[O:8])[c:9]1[cH:10][c:11]([O:24][C:36]([CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH:44]=[CH:45][CH2:46][CH2:47][CH2:48][CH2:49][CH2:50][CH2:51][CH2:52][CH3:53])=[O:54])[c:12]([O:15][C:16]([c:17]2[cH:18][n:19][cH:20][cH:21][cH:22]2)=[O:23])[cH:13][cH:14]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-daf5d50e06384135bf08cce63e014da7
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…