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Potassium Cation → 7-[4-(4-Chlorobenzoyl)benzyl]-1-isopropyl-3-methylxanthine

HRID 186202
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HRID 186202 반응식
[C:29](=[O:30])([O-:31])[O-:32].[CH3:1][n:2]1[c:3](=[O:28])[nH:4][c:5](=[O:27])[c:6]2[n:7]([CH2:11][c:12]3[cH:13][cH:14][c:15]([C:18]([c:19]4[cH:20][cH:21][c:22]([Cl:25])[cH:23][cH:24]4)=[O:26])[cH:16][cH:17]3)[cH:8][n:9][c:10]12.[CH:35]([CH3:36])([CH3:37])[I:38].[K+:33].[K+:34].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH2:44]>>[CH3:1][n:2]1[c:3](=[O:28])[n:4]([CH:35]([CH3:36])[CH3:37])[c:5](=[O:27])[c:6]2[n:7]([CH2:11][c:12]3[cH:13][cH:14][c:15]([C:18]([c:19]4[cH:20][cH:21][c:22]([Cl:25])[cH:23][cH:24]4)=[O:26])[cH:16][cH:17]3)[cH:8][n:9][c:10]12
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7

반응물 6

HCID 813Potassium Cation2회HCID 962WaterHCID 6228DimethylformamideHCID 6362Isopropyl iodideHCID 19660Carbonate IonHCID 189188013-Methyl-7-[4-(4-chlorobenzoyl)benzyl]xanthine

생성물 1

HCID 18919245
7-[4-(4-Chlorobenzoyl)benzyl]-1-isopropyl-3-methylxanthine

출처 및 근거

ORD 기록
ord-08f04c4b77254355818c1c3de81a7173
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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