Ethanol → Ethyl 3-hydroxyheptanoate
반응식
[C:15]=[O:16].[CH3:19][CH2:20][O:21][C:22]([CH3:23])=[O:24].[CH3:25][CH2:26][OH:27].[H:17][H:18].[NH2:1][c:2]1[cH:3][cH:4][n:5][cH:6][cH:7]1.[O:8]1[CH2:9][CH:10]1[CH2:11][CH2:12][CH2:13][CH3:14]>>[OH:8][CH:10]([CH2:9][C:22]([O:21][CH2:20][CH3:19])=[O:24])[CH2:11][CH2:12][CH2:13][CH3:14]참가 물질
7
출처 및 근거
- ORD 기록
- ord-8c2dba39e03344699690b914f876722d
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
반응 노트
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