Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:22:19 UTC
Update Date2025-03-25 01:01:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02252423
Frequency0.5
Structure
Chemical FormulaC14H16N2O
Molecular Mass228.1263
SMILESNCCc1ccc(Nc2ccccc2O)cc1
InChI KeyNORYUSKPAXDLGM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organooxygen compounds
  • organopnictogen compounds
  • secondary amines
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • secondary amine
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amine