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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:19:41 UTC
Update Date2025-03-21 18:36:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00109584
Frequency24.4
Structure
Chemical FormulaC8H6N2O2
Molecular Mass162.0429
SMILESO=[N+]([O-])c1ccc2cc[nH]c2c1
InChI KeyPSWCIARYGITEOY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • nitroaromatic compounds
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrroles
    • Substituents
  • nitroaromatic compound
  • azacycle
  • indole
  • heteroaromatic compound
  • allyl-type 1,3-dipolar organic compound
  • organic 1,3-dipolar compound
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • c-nitro compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organic oxoazanium
  • organic hyponitrite