반응식
[C:1]([n:2]1[cH:3][cH:4][n:5][cH:6]1)([n:7]1[cH:8][cH:9][n:10][cH:11]1)=[O:12].[C:26]([CH3:27])([CH3:28])([CH3:29])[O:30][C:31](=[O:32])[N:33]1[CH2:34][CH2:35][CH:36]([CH2:39][NH2:40])[CH2:37][CH2:38]1.[CH3:41][N:42]([CH3:43])[CH:44]=[O:45].[NH2:13][c:14]1[cH:15][c:16]([O:24][CH3:25])[c:17]([C:18](=[O:19])[OH:20])[cH:21][c:22]1[Cl:23]>>[NH2:13][c:14]1[cH:15][c:16]([O:24][CH3:25])[c:17]([C:18](=[O:20])[NH:40][CH2:39][CH:36]2[CH2:35][CH2:34][N:33]([C:31]([O:30][C:26]([CH3:27])([CH3:28])[CH3:29])=[O:32])[CH2:38][CH2:37]2)[cH:21][c:22]1[Cl:23]참가 물질
5
출처 및 근거
- ORD 기록
- ord-d729a2cb77d0420c9bb51759ec20f28f
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
연결된 노트
불러오는 중…