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CHEBI:36706 - resiquimod

Default Structure
ChEBI IDCHEBI:36706
ChEBI Nameresiquimod
Stars
Last Modified17 October 2009
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC17H22N4O2
Net Charge0
Average Mass314.389
Monoisotopic Mass314.17428
SMILESCCOCc1nc2c(N)nc3ccccc3c2n1CC(C)(C)O
InChIInChI=1S/C17H22N4O2/c1-4-23-9-13-20-14-15(21(13)10-17(2,3)22)11-7-5-6-8-12(11)19-16(14)18/h5-8,22H,4,9-10H2,1-3H3,(H2,18,19)
InChIKeyBXNMTOQRYBFHNZ-UHFFFAOYSA-N
Roles Classification
Biological Roles:
antiviral agent  A substance that destroys or inhibits replication of viruses.
anti-HBV agent  An antiviral agent that destroys or inhibits the replication of the hepatitis B virus.
Application:
antineoplastic agent  A substance that inhibits or prevents the proliferation of neoplasms.
ChEBI Ontology
Outgoing Relation(s)
resiquimod (CHEBI:36706) has role anti-HBV agent (CHEBI:64951)
resiquimod (CHEBI:36706) has role antineoplastic agent (CHEBI:35610)
resiquimod (CHEBI:36706) has role antiviral agent (CHEBI:22587)
resiquimod (CHEBI:36706) is a imidazoquinoline (CHEBI:38776)
resiquimod (CHEBI:36706) is a organic molecular entity (CHEBI:50860)
IUPAC Name 
1-[4-amino-2-(ethoxymethyl)-1H-imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol
Synonyms  Source
CD-11301ChEMBL
CD11301ChEMBL
R 848ChemIDplus
R-848ChemIDplus
R848ChEMBL
ResiquimodChemIDplus
Registry NumbersSources
Beilstein:9792901Beilstein
CAS:144875-48-9ChemIDplus
Citations