Drug Information

Drug General Information
Drug ID
D0Q7WP
Former ID
DNC010208
Drug Name
9-[2-(1-Phosphonobutan-2-yloxy)ethyl]guanine
Drug Type
Small molecular drug
Indication Discovery agent Investigative [530305]
Structure
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2D MOL

3D MOL
Formula
C11H18N5O5P
Canonical SMILES
CCC(CP(=O)(O)O)OCCN1C=NC2=C1NC(=NC2=O)N
InChI
1S/C11H18N5O5P/c1-2-7(5-22(18,19)20)21-4-3-16-6-13-8-9(16)14-11(12)15-10(8)17/h6-7H,2-5H2,1H3,(H2,18,19,20)(H3,12,14,15,17)
InChIKey
RGMQGNHVNYSQHV-UHFFFAOYSA-N
PubChem Compound ID
45101447
Target and Pathway
Target(s) Hypoxanthine-guanine phosphoribosyltransferase Target Info Inhibitor [530305]
KEGG Pathway Purine metabolism
Drug metabolism - other enzymes
Metabolic pathways
PathWhiz Pathway Purine Metabolism
Reactome Purine salvage
WikiPathways Nucleotide Metabolism
Mesodermal Commitment Pathway
Endoderm Differentiation
Metabolism of nucleotides
References
Ref 530305Bioorg Med Chem. 2009 Sep 1;17(17):6218-32. Epub 2009 Jul 25.Synthesis of branched 9-[2-(2-phosphonoethoxy)ethyl]purines as a new class of acyclic nucleoside phosphonates which inhibit Plasmodium falciparum hypoxanthine-guanine-xanthine phosphoribosyltransferase.
Ref 530305Bioorg Med Chem. 2009 Sep 1;17(17):6218-32. Epub 2009 Jul 25.Synthesis of branched 9-[2-(2-phosphonoethoxy)ethyl]purines as a new class of acyclic nucleoside phosphonates which inhibit Plasmodium falciparum hypoxanthine-guanine-xanthine phosphoribosyltransferase.

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