Ethanol → 4-(3-(2,6-Dimethylbenzyloxy)phenyl)-3-butenoic acid
반응식
[CH3:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[cH:7][c:8]([CH:12]=[CH:13][CH2:14][C:15](=[O:16])[O:17][CH2:18][CH3:19])[cH:9][cH:10][cH:11]2)[c:20]([CH3:24])[cH:21][cH:22][cH:23]1.[CH3:27][CH2:28][OH:29].[Na+:26].[OH-:25]>>[CH3:1][c:2]1[c:3]([CH2:4][O:5][c:6]2[cH:7][c:8]([CH:12]=[CH:13][CH2:14][C:15](=[O:16])[OH:17])[cH:9][cH:10][cH:11]2)[c:20]([CH3:24])[cH:21][cH:22][cH:23]1참가 물질
5
출처 및 근거
- ORD 기록
- ord-ba5c7db2712a421b81a707603e2ab075
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (6/10)
반응 노트
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