Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:12:02 UTC
Update Date2025-03-21 18:32:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00090852
Frequency30.9
Structure
Chemical FormulaC13H11NO
Molecular Mass197.0841
SMILESOC1Nc2ccccc2-c2ccccc21
InChI KeyODGNHLPKAVWJAH-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
  • alkanolamines
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • secondary alkylarylamines
  • Substituents
  • azacycle
  • secondary amine
  • secondary aliphatic/aromatic amine
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • phenanthridine
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • alkanolamine