EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:2453 - acyclovir

ChEBI IDCHEBI:2453
ChEBI Nameacyclovir
Stars
DefinitionAn oxopurine that is guanine substituted by a (2-hydroxyethoxy)methyl substituent at position 9. Used in the treatment of viral infections.
Secondary ChEBI IDCHEBI:40459
Last Modified5 February 2025
DownloadsMolfile

FormulaC8H11N5O3
Net Charge0
Average Mass225.208
Monoisotopic Mass225.08619
SMILESNc1nc(=O)c2ncn(COCCO)c2n1
InChIInChI=1S/C8H11N5O3/c9-8-11-6-5(7(15)12-8)10-3-13(6)4-16-2-1-14/h3,14H,1-2,4H2,(H3,9,11,12,15)
InChIKeyMKUXAQIIEYXACX-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
2-amino-9-[(2-hydroxyethoxy)methyl]-1,9-dihydro-6H-purin-6-one
INNs  Source
aciclovirum  laChemIDplus
aciclovir  esChEBI
Synonym  Source
acycloguanosineChEBI
Brand Name  Source
ZovirDrugBank
UniProt Name  Source
acyclovirUniProt
Manual XrefsDatabases
C06810KEGG COMPOUND
AC2PDBeChem
D00222KEGG DRUG
DB00787DrugBank
DE2539963Patent
US4199574Patent
AcyclovirWikipedia
HMDB0014925HMDB
LSM-5459LINCS
85DrugCentral
Registry NumbersSources
Reaxys:1219402Reaxys
CAS:59277-89-3KEGG COMPOUND
CAS:59277-89-3ChemIDplus
Citations