Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:24 UTC
Update Date2025-03-25 00:48:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165676
Frequency0.5
Structure
Chemical FormulaC13H13NO2
Molecular Mass215.0946
SMILESCC=Cc1cc(=O)c2cc(OC)ccc2[nH]1
InChI KeyQSNOKLGWNAFXHV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass quinolones and derivatives
Direct Parent hydroquinolones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroquinolines
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • vinylogous amides
  • Substituents
  • phenol ether
  • ether
  • polyhalopyridine
  • alkyl aryl ether
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • vinylogous amide
  • azacycle
  • heteroaromatic compound
  • dihydroquinoline
  • methylpyridine
  • dihydroquinolone
  • pyridine
  • organic oxygen compound
  • anisole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound