Acetate → [1-(2,2-Dimethylpropionyloxymethyl)-7-(2-formylphenyl)-2,6-dioxo-1,2,6,7-tetrahydropurin-3-yl]methyl 2,2-dimethylpropionate

HRID 947363Notes

Reaction equation

HRID 947363 reaction equation
[C:56]([O-:57])(=[O:58])[CH3:59].[C:61]([O-:62])(=[O:63])[CH3:64].[CH3:1][C:2]([C:3](=[O:4])[O:5][CH2:6][n:7]1[c:8](=[O:25])[n:9]([CH2:17][O:18][C:19]([C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[c:10](=[O:16])[c:11]2[nH:12][cH:13][n:14][c:15]12)([CH3:26])[CH3:27].[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[CH3:50][CH2:51][O:52][C:53](=[O:54])[CH3:55].[CH:28](=[O:29])[c:30]1[c:31]([B:36]([OH:37])[OH:38])[cH:32][cH:33][cH:34][cH:35]1.[Cu+2:60].[cH:39]1[cH:40][cH:41][n:42][cH:43][cH:44]1>>[CH3:1][C:2]([C:3](=[O:4])[O:5][CH2:6][n:7]1[c:8](=[O:25])[n:9]([CH2:17][O:18][C:19]([C:20]([CH3:21])([CH3:22])[CH3:23])=[O:24])[c:10](=[O:16])[c:11]2[n:12](-[c:31]3[c:30]([CH:28]=[O:29])[cH:35][cH:34][cH:33][cH:32]3)[cH:13][n:14][c:15]12)([CH3:26])[CH3:27]

Participants

8

Reactant 7

HCID 175Acetate2×HCID 1049PyridineHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 27099Cupric cationHCID 2921892-Formylphenylboronic acidHCID 153324012,2-Dimethylpropionic acid [3-(2,2-dimethylpropionyloxymethyl)-2,6-dioxo-2,3,6,7-tetrahydropurin-1-yl]methyl ester

Product 1

HCID 23536861[1-(2,2-Dimethylpropionyloxymethyl)-7-(2-formylphenyl)-2,6-dioxo-1,2,6,7-tetrahydropurin-3-yl]methyl 2,2-dimethylpropionate

Sources & evidence

ORD record
ord-3c88ff4ece7d41e981b346deed52318f
Source dataset
Validation data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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