반응식
[C:23](=[NH:24])([O:25][CH2:26][CH3:27])[c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[C:35]([CH3:36])([CH3:37])([CH3:38])[O:39][C:40]([CH:41]([NH2:42])[CH2:43][OH:44])=[O:45].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[C:8]([C:9]([OH:10])=[O:11])([CH2:12][OH:13])[NH2:14].[CH2:46]([Cl:47])[Cl:48].[CH3:15][CH2:16][N:17]([CH2:18][CH3:19])[CH2:20][CH3:21].[ClH:22].[ClH:34]>>[C:1]1([c:2]2[cH:3][cH:4][cH:5][cH:6][cH:7]2)=[N:42][CH:41]([C:40]([O:39][C:35]([CH3:36])([CH3:37])[CH3:38])=[O:45])[CH2:43][O:44]1참가 물질
7
출처 및 근거
- ORD 기록
- ord-6630c2c81fac410ab16ebc6a58b6029b
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
연결된 노트
불러오는 중…