반응식
[C:20]([C:21]([CH3:22])([CH3:23])[CH3:24])(=[O:25])[O:26][CH2:27][Cl:28].[CH3:1][N:2]([CH2:3][CH:4]([C:5]1([OH:11])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1)[c:12]1[cH:13][cH:14][c:15]([OH:18])[cH:16][cH:17]1)[CH3:19].[CH3:35][C:36]#[N:37].[K+:29].[K+:30].[O-:31][C:32]([O-:33])=[O:34]>>[CH3:1][N:2]([CH2:3][CH:4]([C:5]1([OH:11])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10]1)[c:12]1[cH:13][cH:14][c:15]([O:18][CH2:27][O:26][C:20]([C:21]([CH3:22])([CH3:23])[CH3:24])=[O:25])[cH:16][cH:17]1)[CH3:19]참가 물질
6
출처 및 근거
- ORD 기록
- ord-afdbf4040dd7450085b3d4d5d149b1c3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
연결된 노트
불러오는 중…