Bicarbonate Ion → Methyl 2-(1-(3-hydroxyphenyl)cyclohexyl)acetate
반응식
[C:23](=[O:24])([OH:25])[O-:26].[CH3:28][OH:29].[Na+:27].[OH:1][c:2]1[cH:3][c:4]([C:8]2([CH2:14][C:15](=[O:16])[OH:17])[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1.[S:18](=[O:19])(=[O:20])([OH:21])[OH:22]>>[OH:1][c:2]1[cH:3][c:4]([C:8]2([CH2:14][C:15](=[O:16])[O:17][CH3:23])[CH2:9][CH2:10][CH2:11][CH2:12][CH2:13]2)[cH:5][cH:6][cH:7]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-57a68bc3395046f29b809d596e0259cd
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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