Hydroxide → 3-[4-[(2-Tert-butyl-5-methyl-1,3-oxazol-4-yl)methoxy]-2,6-dimethylphenyl]-2-ethoxypropanoic acid
반응식
[CH3:1][O:2][C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:25])[cH:8][c:9]([O:13][CH2:14][c:15]2[n:16][c:17]([C:21]([CH3:22])([CH3:23])[CH3:24])[o:18][c:19]2[CH3:20])[cH:10][c:11]1[CH3:12])[O:26][CH2:27][CH3:28])=[O:29].[Li+:31].[OH-:30]>>[O:2]=[C:3]([CH:4]([CH2:5][c:6]1[c:7]([CH3:25])[cH:8][c:9]([O:13][CH2:14][c:15]2[n:16][c:17]([C:21]([CH3:22])([CH3:23])[CH3:24])[o:18][c:19]2[CH3:20])[cH:10][c:11]1[CH3:12])[O:26][CH2:27][CH3:28])[OH:29]참가 물질
4
출처 및 근거
- ORD 기록
- ord-791e140b50404285a5610bc7f4c47a79
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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