HQO

2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE

Created: 2001-11-28
Last modified:  2021-03-01

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Chemical Details

Formal Charge0
Atom Count40
Chiral Atom Count0
Bond Count41
Aromatic Bond Count11
2D diagram of HQO
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Chemical Component Summary

Name2-HEPTYL-4-HYDROXY QUINOLINE N-OXIDE
Synonyms2-HEPTYL-1-OXY-QUINOLIN-4-OL
Systematic Name (OpenEye OEToolkits)2-heptyl-1-oxido-quinolin-1-ium-4-ol
FormulaC16 H21 N O2
Molecular Weight259.343
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04[O-][n+]2c1ccccc1c(O)cc2CCCCCCC
SMILESCACTVS3.341CCCCCCCc1cc(O)c2ccccc2[n+]1[O-]
SMILESOpenEye OEToolkits1.5.0CCCCCCCc1cc(c2ccccc2[n+]1[O-])O
Canonical SMILESCACTVS3.341 CCCCCCCc1cc(O)c2ccccc2[n+]1[O-]
Canonical SMILESOpenEye OEToolkits1.5.0 CCCCCCCc1cc(c2ccccc2[n+]1[O-])O
InChIInChI1.03 InChI=1S/C16H21NO2/c1-2-3-4-5-6-9-13-12-16(18)14-10-7-8-11-15(14)17(13)19/h7-8,10-12,18H,2-6,9H2,1H3
InChIKeyInChI1.03 NZPACTGCRWDXCJ-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB07918 
Name2-heptyl-4-hydroxyquinoline N-oxide
Groups experimental
Synonyms
  • HQNO
  • 2-heptyl-4-hydroxyquinoline-N-oxide
  • HOQNO
  • 2-heptyl-4-hydroxyquinoline N-oxide
  • 2-(n-heptyl)-4-hydroxyquinoline N-oxide
Categories
  • Heterocyclic Compounds, Fused-Ring
  • Quinolines
CAS number341-88-8

Drug Targets

NameTarget SequencePharmacological ActionActions
Fumarate reductase flavoprotein subunitMQTFQADLAIVGAGGAGLRAAIAAAQANPNAKIALISKVYPMRSHTVAAE...unknown
Fumarate reductase iron-sulfur subunitMAEMKNLKIEVVRYNPEVDTAPHSAFYEVPYDATTSLLDALGYIKDNLAP...unknown
Fumarate reductase subunit CMTTKRKPYVRPMTSTWWKKLPFYRFYMLREGTAVPAVWFSIELIFGLFAL...unknown
Fumarate reductase subunit DMINPNPKRSDEPVFWGLFGAGGMWSAIIAPVMILLVGILLPLGLFPGDAL...unknown
Formate dehydrogenase, nitrate-inducible, major subunitMDVSRRQFFKICAGGMAGTTVAALGFAPKQALAQARNYKLLRAKEIRNTC...unknown
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Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682