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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:17:50 UTC
Update Date2025-03-21 18:35:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00105028
Frequency25.7
Structure
Chemical FormulaC9H7NO
Molecular Mass145.0528
SMILESO=c1c2ccccc1[nH]cc2
InChI KeyNSUQBTNYCGOHPX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasshydrocarbon derivatives
Classtropones
Subclass tropones
Direct Parent tropones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • heteroaromatic compounds
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyridines and derivatives
    • Substituents
  • tropone
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • organic oxide
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound