Acetic Anhydride → 4-Acetoxy-7-cyano-1-(3,4-difluoro-benzyl)-1H-pyrrolo[2,3-c]pyridine-5-carboxylic acid ethyl ester
반응식
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([OH:26])[c:8]2[c:9]([c:10]([C:12]#[N:13])[n:11]1)[n:14]([CH2:17][c:18]1[cH:19][c:20]([F:25])[c:21]([F:24])[cH:22][cH:23]1)[cH:15][cH:16]2.[CH2:34]([N:35]([CH2:36][CH3:37])[CH2:38][CH3:39])[CH3:40].[CH3:27][C:28](=[O:29])[O:30][C:31](=[O:32])[CH3:33]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([O:26][C:28]([CH3:27])=[O:29])[c:8]2[c:9]([c:10]([C:12]#[N:13])[n:11]1)[n:14]([CH2:17][c:18]1[cH:19][c:20]([F:25])[c:21]([F:24])[cH:22][cH:23]1)[cH:15][cH:16]2참가 물질
4
출처 및 근거
- ORD 기록
- ord-9da0004e060e44999768b1739e3169e3
- 출처 데이터셋
- Training data from https://doi.org/10.1039/C8SC04228D (8/10)
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