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38716-45-9

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38716-45-9 Structure

38716-45-9 Structure

Identification	Back Directory
[Name] Adenosine, 5'-S-(2-carboxyethyl)-5'-thio-
[CAS] 38716-45-9
[Synonyms] Adenosine, 5'-S-(2-carboxyethyl)-5'-thio-
[Molecular Formula] C13H17N5O5S
[MOL File] 38716-45-9.mol
[Molecular Weight] 355.37

Chemical Properties	Back Directory
[Boiling point ] 761.2±70.0 °C(Predicted)
[density ] 1.88±0.1 g/cm3(Predicted)
[pka] 4.34±0.10(Predicted)

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[Uses] SARS-CoV-2-IN-78 (compound 3) is an inhibitor for nsp14 of SARS-Cov-2. SARS-CoV-2-IN-78 reveals antiviral activity as N7 methyltrabsferase[1].
[References] [1] Srivastava R, et al. In silico evaluation of S-adenosyl-L-homocysteine analogs as inhibitors of nsp14-viral cap N7 methyltranferase and PLpro of SARS-CoV-2: synthesis, molecular docking, physicochemical data, ADMET and molecular dynamics simulations studies. J Biomol Struct Dyn. 2023 Dec 26:1-18. DOI:10.1080/07391102.2023.2297005

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