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CAS 1207518-71-5

:

4-Amino-7-[2-C-ethynyl-3,5-bis-O-(2-methyl-1-oxopropyl)-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide

Description:
4-Amino-7-[2-C-ethynyl-3,5-bis-O-(2-methyl-1-oxopropyl)-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide is a complex organic compound characterized by its unique structural features, which include a pyrrolo[2,3-d]pyrimidine core, an amino group, and a ribofuranosyl sugar moiety. The presence of the ethynyl group enhances its potential for biological activity, possibly influencing its interaction with nucleic acids or proteins. The compound also contains multiple O-substituents, which may affect its solubility and stability in biological systems. Its carboxamide functional group suggests potential for hydrogen bonding, which could be significant in its mechanism of action. This compound is of interest in medicinal chemistry, particularly in the development of antiviral or anticancer agents, due to its structural resemblance to nucleosides and their derivatives. The specific stereochemistry and substituents contribute to its pharmacological properties, making it a subject of research in drug design and development.
Formula:C22H27N5O7
InChI:InChI=1S/C22H27N5O7/c1-6-22(31)15(34-20(30)11(4)5)13(8-32-19(29)10(2)3)33-21(22)27-7-12(17(24)28)14-16(23)25-9-26-18(14)27/h1,7,9-11,13,15,21,31H,8H2,2-5H3,(H2,24,28)(H2,23,25,26)/t13-,15-,21-,22-/m1/s1
InChI key:InChIKey=XEXIBCFENAZVIS-RHKYQUECSA-N
SMILES:C(#C)[C@]1(O)[C@H](N2C=3C(C(C(N)=O)=C2)=C(N)N=CN3)O[C@H](COC(C(C)C)=O)[C@H]1OC(C(C)C)=O
Synonyms:
  • 4-Amino-7-[2-C-ethynyl-3,5-bis-O-(2-methyl-1-oxopropyl)-β-D-ribofuranosyl]-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide
  • 7H-Pyrrolo[2,3-d]pyrimidine-5-carboxamide, 4-amino-7-[2-C-ethynyl-3,5-bis-O-(2-methyl-1-oxopropyl)-β-D-ribofuranosyl]-
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