CHEBI:63635 - valganciclovir

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ChEBI Name valganciclovir
ChEBI ID CHEBI:63635
Definition The L-valinyl ester of ganciclovir, into which it is rapidly converted by intestinal and hepatic esterases. It is a synthetic analogue of 2'-deoxyguanosine.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Anonymous
Supplier Information Aluminosilicate refers to materials containing anionic Si-O-Al linkages. Commonly, the associate cations are sodium (Na+), potassium (K+) and protons (H+). Such materials occur as minerals, coal combustion products and as synthetic materials, often in the form of zeolites. Both synthetic and natural aluminosilicates are of technical significance as structural materials, catalysts, and reagents.
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Formula C14H22N6O5
Net Charge 0
Average Mass 354.36170
Monoisotopic Mass 354.16517
InChI InChI=1S/C14H22N6O5/c1-7(2)9(15)13(23)24-4-8(3-21)25-6-20-5-17-10-11(20)18-14(16)19-12(10)22/h5,7-9,21H,3-4,6,15H2,1-2H3,(H3,16,18,19,22)/t8?,9-/m0/s1
InChIKey WPVFJKSGQUFQAP-GKAPJAKFSA-N
SMILES CC(C)[C@H](N)C(=O)OCC(CO)OCn1cnc2c1[nH]c(N)nc2=O
Roles Classification
Biological Role(s): antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
Application(s): prodrug
A compound that, on administration, must undergo chemical conversion by metabolic processes before becoming the pharmacologically active drug for which it is a prodrug.
antiviral drug
A substance used in the prophylaxis or therapy of virus diseases.
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ChEBI Ontology
Outgoing valganciclovir (CHEBI:63635) has functional parent ganciclovir (CHEBI:465284)
valganciclovir (CHEBI:63635) has functional parent guanine (CHEBI:16235)
valganciclovir (CHEBI:63635) has role antiviral drug (CHEBI:36044)
valganciclovir (CHEBI:63635) has role prodrug (CHEBI:50266)
valganciclovir (CHEBI:63635) is a L-valyl ester (CHEBI:35855)
valganciclovir (CHEBI:63635) is a purines (CHEBI:26401)
IUPAC Name
2-[(2-amino-6-oxo-3,6-dihydro-9H-purin-9-yl)methoxy]-3-hydroxypropyl L-valinate
INN Source
valganciclovir ChemIDplus
Manual Xrefs Databases
2801 DrugCentral
D02495 KEGG DRUG
DB01610 DrugBank
Valganciclovir Wikipedia
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Registry Numbers Types Sources
14503833 Reaxys Registry Number Reaxys
175865-60-8 CAS Registry Number ChemIDplus
Last Modified
22 February 2017