Ethanol → 5-(2,4-Dichlorophenyl)-4-methylpenta-2,4-dienoic acid
반응식
[CH2:1]([CH3:2])[O:3][C:4]([CH:5]=[CH:6][C:7](=[CH:8][c:9]1[c:10]([Cl:16])[cH:11][c:12]([Cl:15])[cH:13][cH:14]1)[CH3:17])=[O:18].[CH3:21][CH2:22][OH:23].[Na+:20].[OH-:19]>>[O:3]=[C:4]([CH:5]=[CH:6][C:7](=[CH:8][c:9]1[c:10]([Cl:16])[cH:11][c:12]([Cl:15])[cH:13][cH:14]1)[CH3:17])[OH:18]참가 물질
5
출처 및 근거
- ORD 기록
- ord-adfed2b62c48474db3c96f3176497acc
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (4/10)
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