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Clevudine triphosphate

CAT: 0013-GTR19184339-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19184339-02Size:50 mg
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Description
Clevudine triphosphate is a thymidine triphosphate (TTP) analog that acts as a potent inhibitor of hepatitis B virus (HBV) replication. Its unique mechanism involves the inhibition of viral protein priming, independent of competing with natural dNTPs, making it a valuable tool for in vitro enzymatic and antiviral research.
CAS Number
174625-00-4
Field of Research
Infectious Disease & Virology, Pharmacology & Drug Discovery
Smiles
F[C@H]1[C@H] (O[C@@H] (COP (OP (OP (=O) (O) O) (=O) O) (=O) O) [C@@H]1O) N2C (=O) NC (=O) C (C) =C2
Molecular Formula
C10H16FN2O14P3
Molecular Weight
500.16
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Clevudine triphosphate
CAS Number174625-00-4
PubChem CID503024
IUPAC Name[[(2S,3S,4R,5S)-4-fluoro-3-hydroxy-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-hydroxyphosphoryl] phosphono hydrogen phosphate
Molecular FormulaC10H16FN2O14P3
Molecular Weight500.16
XLogP-4.7
Topological Polar Surface Area239
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Heavy Atom Count30
Formal Charge0
Complexity889
SMILES
CC1=CN(C(=O)NC1=O)[C@@H]2[C@@H]([C@H]([C@@H](O2)COP(=O)(O)OP(=O)(O)OP(=O)(O)O)O)F
InChI
InChI=1S/C10H16FN2O14P3/c1-4-2-13(10(16)12-8(4)15)9-6(11)7(14)5(25-9)3-24-29(20,21)27-30(22,23)26-28(17,18)19/h2,5-7,9,14H,3H2,1H3,(H,20,21)(H,22,23)(H,12,15,16)(H2,17,18,19)/t5-,6+,7-,9-/m0/s1
InChIKey
RUKRVHYQIIURNV-XQXXSGGOSA-N
Chemical Structure
2D Structure
2D structure of Clevudine triphosphate
CAS: 174625-00-4
CID: 503024
Formula: C10H16FN2O14P3
MW: 500.16
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight500.16
XLogP3-4.7
Hydrogen Bond Donor Count6
Hydrogen Bond Acceptor Count15
Rotatable Bond Count8
Exact Mass499.97984234
Monoisotopic Mass499.97984234
Topological Polar Surface Area239 Ų
Heavy Atom Count30
Formal Charge0
Complexity889
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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