Ethanol → 7-Amino-5,5-dimethyl-1,3,4,5-tetrahydro-benzo[b]azepin-2-one
반응식
[CH3:21][CH2:22][OH:23].[CH3:4][C:5]1([CH3:20])[c:6]2[c:7]([cH:13][cH:14][c:15]([N+:17]([O-:18])=[O:19])[cH:16]2)[NH:8][C:9](=[O:12])[CH2:10][CH2:11]1.[NH2:2][NH2:3].[OH2:1]>>[CH3:4][C:5]1([CH3:20])[c:6]2[c:7]([cH:13][cH:14][c:15]([NH2:17])[cH:16]2)[NH:8][C:9](=[O:12])[CH2:10][CH2:11]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-dbe5e24c87ec4660a2c55089981bffbd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (2/10)
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