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PSI-7409 (tetrasodium)

CAT: 0804-HY-15745A-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-15745A-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PSI-7409 tetrasodium is an active 5'-triphosphate metabolite of sofosbuvir (PSI-7977), inhibiting HCV NS5B polymerases, with IC50s of 1.6, 2.8, 0.7 and 2.6 μM for GT 1b_Con1, GT 2a_JFH1, GT 3a, and GT 4a NS5B polymerases, respectively.
CAS Number
1621884-22-7
UNSPSC
12352005
Target
HCV
Related Pathways
Anti-infection
Applications
COVID-19-anti-virus
Field of Research
Infection
Purity
99.31
Solubility
H2O : ≥ 100 mg/mL
Smiles
O[C@@H]([C@@](C)(F)[C@H](N1C(NC(C=C1)=O)=O)O2)[C@H]2COP(OP(OP(O[Na])(O[Na])=O)(O[Na])=O)(O[Na])=O
Molecular Formula
C10H12FN2Na4O14P3
Molecular Weight
588.09
References & Citations
[1]Lam AM, et al. PSI-7851, a pronucleotide of beta-D-2'-deoxy-2'-fluoro-2'-C-methyluridine monophosphate, is a potent and pan-genotype inhibitor of hepatitis C virus replication. Antimicrob Agents Chemother. 2010 Aug;54 (8) :3187-96.|[2]Murakami E, et al. Mechanism of activation of PSI-7851 and its diastereoisomer PSI-7977. J Biol Chem. 2010 Nov 5;285 (45) :34337-47.
Shipping Conditions
Blue Ice
Storage Conditions
-20°C (Powder, sealed storage, away from moisture)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Citation 01
Asian J Pharm Sci. 2021 Nov;16 (6) :772-783.|J Med Chem. 2025 Jun 26;68 (12) :12414-12433.|Antiviral Res. 2020 Mar;175:104708.|Biochem Biophys Res Commun. 2023 Jan 22:641:50-56.|Cell. 2022 Nov 10;185 (23) :4347-4360.e17.|J Virol Methods. 2021 Dec:298:114283.|Microbiol Spectr. 2022 Oct 26;10 (5) :e0272922.

Chemical Information

PSI-7409 tetrasodium
CAS Number1621884-22-7
PubChem CID170907776
IUPAC Nametetrasodium;[[[(2R,3R,4R,5R)-5-(2,4-dioxopyrimidin-1-yl)-4-fluoro-3-hydroxy-4-methyloxolan-2-yl]methoxy-oxidophosphoryl]oxy-oxidophosphoryl] phosphate
Molecular FormulaC10H12FN2Na4O14P3
Molecular Weight588.09
Topological Polar Surface Area250
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Heavy Atom Count34
Formal Charge0
Complexity863
SMILES
C[C@]1([C@@H]([C@H](O[C@H]1N2C=CC(=O)NC2=O)COP(=O)([O-])OP(=O)([O-])OP(=O)([O-])[O-])O)F.[Na+].[Na+].[Na+].[Na+]
InChI
InChI=1S/C10H16FN2O14P3.4Na/c1-10(11)7(15)5(25-8(10)13-3-2-6(14)12-9(13)16)4-24-29(20,21)27-30(22,23)26-28(17,18)19;;;;/h2-3,5,7-8,15H,4H2,1H3,(H,20,21)(H,22,23)(H,12,14,16)(H2,17,18,19);;;;/q;4*+1/p-4/t5-,7-,8-,10-;;;;/m1..../s1
InChIKey
MEVRFPOAFPAGDY-DLULJLDFSA-J
Chemical Structure
2D Structure
2D structure of PSI-7409 tetrasodium
CAS: 1621884-22-7
CID: 170907776
Formula: C10H12FN2Na4O14P3
MW: 588.09
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight588.09
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count15
Rotatable Bond Count7
Exact Mass587.90761934
Monoisotopic Mass587.90761934
Topological Polar Surface Area250 Ų
Heavy Atom Count34
Formal Charge0
Complexity863
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
GTR19204232-01PSI-7409 tetrasodium
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A13962-5PSI-7409 5mg
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A13962-1PSI-7409 1mg
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