반응식
[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[cH:8][cH:9][c:10]([CH2:13][C:14]#[N:15])[cH:11][cH:12]1.[CH3:16][O:17][C:18](=[O:19])[O:20][CH3:21].[H-:1].[Na+:2].[O:22]1[CH2:23][CH2:24][CH2:25][CH2:26]1>>[C:3]([CH3:4])([CH3:5])([CH3:6])[c:7]1[cH:8][cH:9][c:10]([CH:13]([C:14]#[N:15])[C:18]([O:17][CH3:16])=[O:19])[cH:11][cH:12]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-ffec489390c24492a68956810db38868
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…