Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:52:08 UTC
Update Date2025-03-25 00:50:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02183340
Frequency0.5
Structure
Chemical FormulaC14H10N2O
Molecular Mass222.0793
SMILESO=C(c1ccccc1)c1c[nH]c2cnccc12
InChI KeyCODWUIWVWKGMET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent aryl-phenylketones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl ketones
  • azacyclic compounds
  • benzoyl derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • pyridines and derivatives
  • pyrroles
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • monocyclic benzene moiety
  • azacycle
  • polyhalopyridine
  • aryl-phenylketone
  • heteroaromatic compound
  • benzoyl
  • organic oxide
  • pyridine
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organoheterocyclic compound