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Potassium Cation → N-{2-fluoro-3-[hydroxy-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-methyl]-phenyl}-4-trifluoromethyl-benzenesulfonamide

HRID 2161901
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HRID 2161901 반응식
[CH3:36][OH:37].[F:1][c:2]1[c:3]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[cH:4][cH:5][cH:6][c:7]1[CH:8]=[O:9].[K+:34].[OH-:33].[OH2:35].[n:24]1[cH:25][n:26][cH:27][c:28]2[c:29]1[nH:30][cH:31][cH:32]2>>[F:1][c:2]1[c:3]([NH:10][S:11](=[O:12])(=[O:13])[c:14]2[cH:15][cH:16][c:17]([C:20]([F:21])([F:22])[F:23])[cH:18][cH:19]2)[cH:4][cH:5][cH:6][c:7]1[CH:8]([OH:9])[c:32]1[c:28]2[cH:27][n:26][cH:25][n:24][c:29]2[nH:30][cH:31]1
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HCID 813Potassium CationHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 2615917H-Pyrrolo(2,3-d)pyrimidineHCID 57963257N-(2-fluoro-3-formyl-phenyl)-4-trifluoromethyl-benzenesulfonamide

생성물 1

출처 및 근거

ORD 기록
ord-0a0312e378024e78a2aaec80cc04195c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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HCID 57963304
N-{2-fluoro-3-[hydroxy-(7H-pyrrolo[2,3-d]pyrimidin-5-yl)-methyl]-phenyl}-4-trifluoromethyl-benzenesulfonamide