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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:37 UTC
Update Date2025-03-25 00:49:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177674
Frequency0.5
Structure
Chemical FormulaC15H15NO4
Molecular Mass273.1001
SMILESOc1cc(O)c2c(c1)NC(c1ccc(O)c(O)c1)CC2
InChI KeyZYHNNJVRCLQPRU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classquinolines and derivatives
Subclass phenylquinolines
Direct Parent phenylquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • hydroquinolines
  • organooxygen compounds
  • organopnictogen compounds
  • secondary alkylarylamines
  • Substituents
  • monocyclic benzene moiety
  • azacycle
  • phenylquinoline
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • tetrahydroquinoline
  • amine
  • organooxygen compound