Sodium Ion → 2-(2-(tert-Butyl)pyrimidin-5-yl)-3-methylbut-2-enoic acid
반응식
[CH3:3][C:4]([CH3:5])([CH3:6])[c:7]1[n:8][cH:9][c:10]([C:13]([C:14](=[O:15])[O:16][CH2:17][CH3:18])=[C:19]([CH3:20])[CH3:21])[cH:11][n:12]1.[CH:22]([OH:23])([CH3:24])[CH3:25].[Na+:2].[OH-:1].[OH2:26]>>[CH3:3][C:4]([CH3:5])([CH3:6])[c:7]1[n:8][cH:9][c:10]([C:13]([C:14](=[O:15])[OH:16])=[C:19]([CH3:20])[CH3:21])[cH:11][n:12]1참가 물질
6
출처 및 근거
- ORD 기록
- ord-33dcd61762f04735962751644ea874d8
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
반응 노트
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