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Sodium Ion → 2-(ethoxymethyl)-1-({1-[2-(methylsulfonyl)ethoxy]cyclohexyl}methyl)-1H-imidazo[4,5-c]quinoline

HRID 184499
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HRID 184499 반응식
[CH2:9]([CH3:10])[O:11][CH2:12][c:13]1[n:14]([CH2:26][C:27]2([OH:33])[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]2)[c:15]2[c:16]([cH:17][n:18][c:19]3[cH:20][cH:21][cH:22][cH:23][c:24]23)[n:25]1.[CH:3](=[CH2:4])[S:5](=[O:6])(=[O:7])[CH3:8].[H-:1].[Na+:2].[O:35]1[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH2:34]>>[CH2:3]([CH2:4][O:33][C:27]1([CH2:26][n:14]2[c:13]([CH2:12][O:11][CH2:9][CH3:10])[n:25][c:16]3[c:15]2[c:24]2[c:19]([n:18][cH:17]3)[cH:20][cH:21][cH:22][cH:23]2)[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32]1)[S:5](=[O:6])(=[O:7])[CH3:8]
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반응물 6

HCID 923Sodium IonHCID 962WaterHCID 8028TetrahydrofuranHCID 19354Methyl vinyl sulfoneHCID 166653HydrideHCID 575153771-{[2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl]methyl}cyclohexanol

생성물 1

HCID 67204053
2-(ethoxymethyl)-1-({1-[2-(methylsulfonyl)ethoxy]cyclohexyl}methyl)-1H-imidazo[4,5-c]quinoline

출처 및 근거

ORD 기록
ord-c67cb323deb74f80a9ad8d774d69497d
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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