Water → 5-(2-Fluoro-3-methoxybenzylidene)-2,2-dimethyl-1,3-dioxane-4,6-dione
반응식
[CH3:12][C:13]1([CH3:21])[O:14][C:15](=[O:20])[CH2:16][C:17](=[O:19])[O:18]1.[F:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][cH:8][c:9]1[O:10][CH3:11].[OH2:22]>>[F:1][c:2]1[c:3]([CH:4]=[C:16]2[C:15](=[O:20])[O:14][C:13]([CH3:12])([CH3:21])[O:18][C:17]2=[O:19])[cH:6][cH:7][cH:8][c:9]1[O:10][CH3:11]참가 물질
4
출처 및 근거
- ORD 기록
- ord-aca9be7915b4417889ff534674dceff8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
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