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Substrate Report for: Valacyclovir

Valacyclovir is an ester of acyclovir a Herpes Simplex Virus Nucleoside Analog DNA Polymerase Inhibitor. Orally administered, valacyclovir is rapidly converted by Valacyclovir hydrolase a biphenyl hydrolase-like


General
Type Purine, Drug, Not A/B H target, Nucleoside
Chemical_Nomenclature 2-[(2-amino-6-oxo-3H-purin-9-yl)methoxy]ethyl (2S)-2-amino-3-methylbutanoate
Canonical SMILES CC(C)C(C(=O)OCCOCN1C=NC2=C1NC(=NC2=O)N)N CC(C)C(C(=O)OCCOCN1C=NC2=C1N=C(NC2=O)N)N
InChI InChI=1S/C13H20N6O4/c1-7(2)8(14)12(21)23-4-3-22-6-19-5-16-9-10(19)17-13(15)18-11(9)20/h5,7-8H,3-4,6,14H2,1-2H3,(H3,15,17,18,20)/t8-/m0/s1
InChIKey HDOVUKNUBWVHOX-QMMMGPOBSA-N
Other name(s) Valaciclovir ; Valtrex ; Zelitrex ; ValACV
________________________________________________________________________________________________
MW|324.33
Formula|C13H20N6O4
CAS_number|124832-26-4
PubChem|60773, 135398742
UniChem|HDOVUKNUBWVHOX-QMMMGPOBSA-N
IUPHAR|4824
Wikipedia|Valacyclovir

Target
Families | Valacyclovir ligand of proteins in family: Valacyclovir-hydrolase
Protein | human-BPHL, mouse-bphl

References:
Search PubMed for references concerning: Valacyclovir

2 more
    Title: Specificity of a prodrug-activating enzyme hVACVase: the leaving group effect
    Sun J, Dahan A, Walls ZF, Lai L, Lee KD, Amidon GL
    Ref: Mol Pharm, 7:2362, 2010 : PubMed

            

    Title: Molecular basis of prodrug activation by human valacyclovirase, an alpha-amino acid ester hydrolase
    Lai L, Xu Z, Zhou J, Lee KD, Amidon GL
    Ref: Journal of Biological Chemistry, 283:9318, 2008 : PubMed

            

    Title: Identification of a human valacyclovirase: biphenyl hydrolase-like protein as valacyclovir hydrolase
    Kim I, Chu XY, Kim S, Provoda CJ, Lee KD, Amidon GL
    Ref: Journal of Biological Chemistry, 278:25348, 2003 : PubMed