Ethanol → 4-Hydroxymethylpyrazolo[1,5-a]pyridine-2-carboxylic acid ethyl ester
반응식
[CH3:1][C:2]([Cl:3])=[O:4].[CH3:24][CH2:25][OH:26].[Na+:23].[O-:19][C:20]([OH:21])=[O:22].[OH:5][CH2:6][c:7]1[c:8]2[n:9]([cH:10][cH:11][cH:12]1)[n:13][c:14]([C:16](=[O:17])[OH:18])[cH:15]2>>[CH3:1][CH2:2][O:4][C:16]([c:14]1[n:13][n:9]2[c:8]([c:7]([CH2:6][OH:5])[cH:12][cH:11][cH:10]2)[cH:15]1)=[O:17]참가 물질
6
출처 및 근거
- ORD 기록
- ord-cb5e5ef5d97c4d86bd9bc4bc8566136c
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (9/10)
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