반응식
[CH3:1][C:2]1([CH3:15])[CH:3]2[CH:4]([c:5]3[cH:6][c:7]([C:12]#[N:13])[cH:8][cH:9][c:10]3[O:11]1)[O:14]2.[n:16]1[cH:17][n:18][c:19]([OH:26])[c:20]2[cH:21][cH:22][cH:23][cH:24][c:25]12>>[CH3:1][C:2]1([CH3:15])[CH:3]([OH:14])[CH:4]([O:26][c:19]2[n:18][cH:17][n:16][c:25]3[c:20]2[cH:21][cH:22][cH:23][cH:24]3)[c:5]2[cH:6][c:7]([C:12]#[N:13])[cH:8][cH:9][c:10]2[O:11]1참가 물질
3
출처 및 근거
- ORD 기록
- ord-820e869186af475ea67653473b321a41
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
연결된 노트
불러오는 중…