Ethanol → 1-(3-Amino-7,8-dihydro-6H-5-oxa-9-aza-benzocyclohepten-9-yl)-ethanone
반응식
[CH3:20][CH2:21][OH:22].[H:18][H:19].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][c:6]2[c:7]([cH:16][cH:17]1)[N:8]([C:13]([CH3:14])=[O:15])[CH2:9][CH2:10][CH2:11][O:12]2>>[NH2:1][c:4]1[cH:5][c:6]2[c:7]([cH:16][cH:17]1)[N:8]([C:13]([CH3:14])=[O:15])[CH2:9][CH2:10][CH2:11][O:12]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-6a835500d6bb4f5b9266d18b6da570ed
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (3/10)
반응 노트
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