반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][c:6]1[c:7]([CH3:21])[c:8]([CH:15]2[CH:16]([CH2:18][C:19]#[N:20])[CH2:17]2)[n:9][cH:10][c:11]1[N+:12](=[O:13])[O-:14].[OH:22][C:23]([C:24]([F:25])([F:26])[F:27])=[O:28]>>[OH:5][c:6]1[c:7]([CH3:21])[c:8]([CH:15]2[CH:16]([CH2:18][C:19]#[N:20])[CH2:17]2)[n:9][cH:10][c:11]1[N+:12](=[O:13])[O-:14]참가 물질
3
출처 및 근거
- ORD 기록
- ord-2a380b41859a4e0d9328cc547dfc7963
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
연결된 노트
불러오는 중…