Ethanol → 4-[[7-[(2-Methylpropan-2-yl)oxycarbonylamino]-5,6,7,8-tetrahydronaphthalen-2-yl]oxy]butanoic acid
반응식
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]1[CH2:10][c:11]2[cH:12][c:13]([O:19][CH2:20][CH2:21][CH2:22][C:23](=[O:24])[O:25][CH2:26][CH3:27])[cH:14][cH:15][c:16]2[CH2:17][CH2:18]1.[CH3:28][OH:29].[CH3:30][CH2:31][OH:32].[Na+:34].[OH-:33]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH:9]1[CH2:10][c:11]2[cH:12][c:13]([O:19][CH2:20][CH2:21][CH2:22][C:23](=[O:24])[OH:25])[cH:14][cH:15][c:16]2[CH2:17][CH2:18]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-0301118b69a44c92a33fc14c583d4094
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
반응 노트
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