Methanol → 1-(4-Aminophenyl)-3-ethyl-3-azabicyclo[3.1.1]heptane-2,4-dione
반응식
[CH2:1]([CH3:2])[N:3]1[C:4](=[O:20])[C:5]2([c:11]3[cH:12][cH:13][c:14]([N+:17]([O-:18])=[O:19])[cH:15][cH:16]3)[CH2:6][CH:7]([C:8]1=[O:9])[CH2:10]2.[CH3:21][OH:22]>>[CH2:1]([CH3:2])[N:3]1[C:4](=[O:20])[C:5]2([c:11]3[cH:12][cH:13][c:14]([NH2:17])[cH:15][cH:16]3)[CH2:6][CH:7]([C:8]1=[O:9])[CH2:10]2참가 물질
3
출처 및 근거
- ORD 기록
- ord-84555341e7e74413bf6b618801f9161c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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