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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:53 UTC
Update Date2025-03-25 00:56:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221914
Frequency0.5
Structure
Chemical FormulaC17H17NO4
Molecular Mass299.1158
SMILESO=c1c2ccccc2c2ccccc2n1CC(O)C(O)CO
InChI KeySAGREOFZVQKYBH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass benzoquinolines
Direct Parent phenanthridines and derivatives
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • azacyclic compounds
  • benzenoids
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroquinolines
  • hydroquinolones
  • hydroxypyridines
  • isoquinolones and derivatives
  • lactams
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • polyhalopyridines
  • primary alcohols
  • pyridinones
  • secondary alcohols
  • Substituents
  • lactam
  • polyhalopyridine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • isoquinolone
  • 2-halopyridine
  • primary alcohol
  • alcohol
  • azacycle
  • heteroaromatic compound
  • hydroxypyridine
  • dihydroquinoline
  • dihydroquinolone
  • pyridine
  • organic oxygen compound
  • isoquinoline
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • phenanthridine
  • organic nitrogen compound
  • pyridinone
  • organooxygen compound