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Valomaciclovir

CAT: 0013-GTR19209956-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19209956-02Size:50 mg
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Description
Valomaciclovir is a nucleoside analog DNA polymerase inhibitor used in research for herpes zoster and Epstein-Barr virus infections. Its antiviral activity and mechanism of action are studied in both in vitro assays and in vivo animal models of viral replication.
CAS Number
195157-34-7
Field of Research
Cell Biology, Molecular Biology
Smiles
C ([C@@H] (CCOC ([C@H] (C (C) C) N) =O) CO) N1C2=C (N=C1) C (=O) N=C (N) N2
Molecular Formula
C15H24N6O4
Molecular Weight
352.39
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Valomaciclovir

Valomaciclovir is a prodrug form of the acyclic guanosine derivative omaciclovir with activity against varicella zoster virus (VZV) and other members of the herpesvirus family. Valomaciclovir is converted in vivo to omaciclovir, a nucleoside analog inhibitor of VZV DNA polymerase.

CAS Number195157-34-7
PubChem CID135544014
IUPAC Name[(3R)-3-[(2-amino-6-oxo-1H-purin-9-yl)methyl]-4-hydroxybutyl] (2S)-2-amino-3-methylbutanoate
Molecular FormulaC15H24N6O4
Molecular Weight352.39
XLogP-0.9
Topological Polar Surface Area158
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Heavy Atom Count25
Formal Charge0
Complexity526
SMILES
CC(C)[C@@H](C(=O)OCC[C@H](CN1C=NC2=C1N=C(NC2=O)N)CO)N
InChI
InChI=1S/C15H24N6O4/c1-8(2)10(16)14(24)25-4-3-9(6-22)5-21-7-18-11-12(21)19-15(17)20-13(11)23/h7-10,22H,3-6,16H2,1-2H3,(H3,17,19,20,23)/t9-,10+/m1/s1
InChIKey
ATSZELKUSAREPW-ZJUUUORDSA-N
Chemical Structure
2D Structure
2D structure of Valomaciclovir
CAS: 195157-34-7
CID: 135544014
Formula: C15H24N6O4
MW: 352.39
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight352.39
XLogP3-0.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count7
Rotatable Bond Count9
Exact Mass352.18590327
Monoisotopic Mass352.18590327
Topological Polar Surface Area158 Ų
Heavy Atom Count25
Formal Charge0
Complexity526
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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