Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:43 UTC
Update Date2025-03-21 18:39:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123979
Frequency28.8
Structure
Chemical FormulaC12H13NO
Molecular Mass187.0997
SMILESCc1cc2[nH]cc(C)c(=O)c2cc1C
InChI KeyHPWKWSANVPBHKO-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
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroquinolines
  • methylpyridines
  • organic oxides
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • vinylogous amides
  • Substituents
  • vinylogous amide
  • azacycle
  • polyhalopyridine
  • heteroaromatic compound
  • dihydroquinoline
  • methylpyridine
  • organic oxide
  • dihydroquinolone
  • pyridine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • 2-halopyridine
  • organic nitrogen compound
  • organooxygen compound