반응식
[C-:37]#[N:38].[C:24](=[O:25])([O-:26])[O-:27].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[NH2:1][c:2]1[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7]([c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1)([CH2:18][CH2:19][CH2:20][N:21]([CH3:22])[CH3:23])[O:6][CH2:5]2.[Na+:28].[Na+:29].[Na+:39].[OH2:40]>>[c:2]1([C:37]#[N:38])[cH:3][c:4]2[c:8]([cH:9][cH:10]1)[C:7]([c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1)([CH2:18][CH2:19][CH2:20][N:21]([CH3:22])[CH3:23])[O:6][CH2:5]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-6d7e9e3d67e04fdfa645beab0fad83e5
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…