Ethanol → [(2-Methyl-4-{2-[4'-(trifluoromethyl)-3-biphenylyl]ethyl}phenyl)oxy]acetic acid
반응식
[CH3:1][c:2]1[c:3]([O:26][CH2:27][C:28](=[O:29])[OH:30])[cH:4][cH:5][c:6]([CH:8]=[CH:9][c:10]2[cH:11][c:12](-[c:16]3[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[cH:13][cH:14][cH:15]2)[cH:7]1.[CH3:33][CH2:34][OH:35].[H:31][H:32]>>[CH3:1][c:2]1[c:3]([O:26][CH2:27][C:28](=[O:29])[OH:30])[cH:4][cH:5][c:6]([CH2:8][CH2:9][c:10]2[cH:11][c:12](-[c:16]3[cH:17][cH:18][c:19]([C:22]([F:23])([F:24])[F:25])[cH:20][cH:21]3)[cH:13][cH:14][cH:15]2)[cH:7]1참가 물질
4
출처 및 근거
- ORD 기록
- ord-f1a49bb308ea44e7b3f40012b2a0d77a
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
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