NQ

2-HYDROXYNAPHTHOQUINONE

Created:2005-08-03
Last modified:  2020-06-05

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Chemical Details

Formal Charge0
Atom Count19
Chiral Atom Count0
Bond Count20
Aromatic Bond Count6
2D diagram of NQ
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Chemical Component Summary

Name2-HYDROXYNAPHTHOQUINONE
Synonyms2-HYDROXY-1,4-NAPHTHOQUINONE
Systematic Name (OpenEye OEToolkits)2-hydroxynaphthalene-1,4-dione
FormulaC10 H6 O3
Molecular Weight174.153
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C2c1c(cccc1)C(=O)C(O)=C2
SMILESCACTVS3.341OC1=CC(=O)c2ccccc2C1=O
SMILESOpenEye OEToolkits1.5.0c1ccc2c(c1)C(=O)C=C(C2=O)O
Canonical SMILESCACTVS3.341 OC1=CC(=O)c2ccccc2C1=O
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc2c(c1)C(=O)C=C(C2=O)O
InChIInChI1.03 InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,12H
InChIKeyInChI1.03 CSFWPUWCSPOLJW-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank data are sourced from datasets licensed under a Creative Common's Attribution-NonCommercial 4.0 International License
DrugBank IDDB04744 
NameLawsone
Groups experimental
Synonyms
  • 2-hydroxynaphthoquinone
  • 2-hydroxy-1,4-naphthalenedione
  • 2-hydroxy-1,4-naphthoquinone
  • Lawsone
Categories
  • Anti-Infective Agents
  • Antifungal Agents
  • Coloring Agents
  • Compounds used in a research, industrial, or household setting
  • Cosmetics
CAS number83-72-7

Related Resource References

Resource NameReference
CCDC/CSD TELYAK, GUNXAQ, GUNWIX, TELYAK01, GUNWUJ, TELYAK03, TELYAK02
COD 2005557, 7222008