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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:26 UTC
Update Date2025-03-25 00:54:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02204543
Frequency0.5
Structure
Chemical FormulaC10H7NO
Molecular Mass157.0528
SMILESO=Nc1ccc2ccccc2c1
InChI KeyXHWGWRUGGACWLV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • c-nitroso compounds
  • hydrocarbon derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • organic nitroso compound
  • aromatic homopolycyclic compound
  • organic 1,3-dipolar compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • naphthalene
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • c-nitroso compound
  • hydrocarbon derivative
  • organic nitrogen compound