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CAS 6161-23-5

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[(2R,3R,5R)-3-acetoxy-5-(5-bromo-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl acetate

Description:
The chemical substance with the name "[(2R,3R,5R)-3-acetoxy-5-(5-bromo-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl acetate" and CAS number 6161-23-5 is a complex organic compound characterized by its specific stereochemistry and functional groups. It features a tetrahydrofuran ring, which is a five-membered cyclic ether, and incorporates an acetoxy group, indicating the presence of an ester functional group. The compound also contains a pyrimidine moiety, which is a six-membered aromatic ring with nitrogen atoms, further modified by bromine and keto groups, contributing to its reactivity and potential biological activity. The stereochemistry, denoted by the (2R,3R,5R) configuration, suggests that the compound has specific three-dimensional orientations that can influence its interactions in biological systems. This compound may exhibit pharmacological properties, making it of interest in medicinal chemistry, particularly in the development of therapeutic agents. Its unique structure and functional groups suggest potential applications in drug design and synthesis.
Formula:C13H15BrN2O7
InChI:InChI=1/C13H15BrN2O7/c1-6(17)21-5-10-9(22-7(2)18)3-11(23-10)16-4-8(14)12(19)15-13(16)20/h4,9-11H,3,5H2,1-2H3,(H,15,19,20)/t9-,10-,11-/m1/s1
SMILES:CC(=O)OC[C@@H]1[C@@H](C[C@H](n2cc(c(nc2=O)O)Br)O1)OC(=O)C
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