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Acetate → tert-butyl 3-(6-amino-8-oxo-7-(4-phenoxyphenyl)-7H-purin-9(8H)-yl)phenyl(methyl)carbamate

HRID 683557
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HRID 683557 반응식
[C:54]([O-:55])(=[O:56])[CH3:57].[C:59]([O-:60])(=[O:61])[CH3:62].[Cu+2:58].[NH2:1][c:2]1[c:3]2[nH:4][c:5](=[O:26])[n:6](-[c:11]3[cH:12][c:13]([N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH3:25])[cH:14][cH:15][cH:16]3)[c:7]2[n:8][cH:9][n:10]1.[O:27]([c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1)[c:34]1[cH:35][cH:36][c:37]([B:40]([OH:41])[OH:42])[cH:38][cH:39]1.[O:49]=[CH:50][N:51]([CH3:52])[CH3:53].[cH:43]1[cH:44][cH:45][n:46][cH:47][cH:48]1>>[NH2:1][c:2]1[c:3]2[n:4](-[c:37]3[cH:36][cH:35][c:34]([O:27][c:28]4[cH:29][cH:30][cH:31][cH:32][cH:33]4)[cH:39][cH:38]3)[c:5](=[O:26])[n:6](-[c:11]3[cH:12][c:13]([N:17]([C:18]([O:19][C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[CH3:25])[cH:14][cH:15][cH:16]3)[c:7]2[n:8][cH:9][n:10]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 175Acetate2회HCID 1049PyridineHCID 6228DimethylformamideHCID 27099Cupric cationHCID 27343774-Phenoxyphenylboronic acidHCID 86691218tert-butyl 3-(6-amino-8-oxo-7H-purin-9(8H)-yl)phenyl(methyl)carbamate

생성물 1

HCID 86691219
tert-butyl 3-(6-amino-8-oxo-7-(4-phenoxyphenyl)-7H-purin-9(8H)-yl)phenyl(methyl)carbamate

출처 및 근거

ORD 기록
ord-59465018f0ff4641958ab913c1a6e9b1
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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