반응식
[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[O:9])[cH:10][cH:11]1.[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[CH:12]1([NH:17][OH:18])[CH2:13][CH2:14][CH2:15][CH2:16]1.[OH2:19].[c:20]1([CH3:21])[cH:22][cH:23][c:24]([S:25]([OH:26])(=[O:27])=[O:28])[cH:29][cH:30]1>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]([CH:8]=[N+:17]([CH:12]2[CH2:13][CH2:14][CH2:15][CH2:16]2)[O-:18])[cH:10][cH:11]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-352a7da267d641f396d3e5c326074bae
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…