Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:56 UTC
Update Date2025-03-25 00:57:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222026
Frequency0.5
Structure
Chemical FormulaC17H19NO3
Molecular Mass285.1365
SMILESOc1ccc(CNC2CCc3cc(O)c(O)cc3C2)cc1
InChI KeyKGGCNDJIWLSACN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • tetralin
  • secondary aliphatic amine
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • secondary amine
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine