Ethyl Acetate → 6-(4-Heptoxyphenyl)-4-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]hexanoic acid
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH:10]=[CH:11][C:12](=[O:13])[OH:14])([CH2:15][CH2:16][c:17]1[cH:18][cH:19][c:20]([O:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[cH:21][cH:22]1)[CH3:31].[CH3:32][CH2:33][O:34][C:35]([CH3:36])=[O:37]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][C:9]([CH2:10][CH2:11][C:12](=[O:13])[OH:14])([CH2:15][CH2:16][c:17]1[cH:18][cH:19][c:20]([O:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[cH:21][cH:22]1)[CH3:31]참가 물질
3
출처 및 근거
- ORD 기록
- ord-c459882efcfa4ceaa6773765e4b5bcbf
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
반응 노트
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