Acetate → 3-(Hydroxymethyl)imidazo[1,2-a]pyridine-6-carbonitrile
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[C:19](=[O:20])([O-:21])[O-:22].[CH2:17]=[O:18].[CH3:13][C:14]([O-:15])=[O:16].[CH3:25][C:26](=[O:27])[OH:28].[Na+:12].[Na+:23].[Na+:24].[n:1]1[cH:2][cH:3][n:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]#[N:11])[cH:9]2>>[n:1]1[cH:2][c:3]([CH2:14][OH:15])[n:4]2[c:5]1[cH:6][cH:7][c:8]([C:10]#[N:11])[cH:9]2참가 물질
7
출처 및 근거
- ORD 기록
- ord-b037692aec5b498bbef142997138ba5e
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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