Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:14 UTC
Update Date2025-03-25 00:49:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02172136
Frequency0.5
Structure
Chemical FormulaC12H15N
Molecular Mass173.1204
SMILESCN1C2CCC1(C)c1ccccc12
InChI KeyNGPKZBVLTWYYOL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aralkylamines
  • azacyclic compounds
  • hydrocarbon derivatives
  • isoindoles
  • isoindolines
  • n-alkylpyrrolidines
  • organopnictogen compounds
  • trialkylamines
  • Substituents
  • tetralin
  • azacycle
  • n-alkylpyrrolidine
  • isoindole
  • tertiary aliphatic amine
  • aralkylamine
  • isoindoline
  • aromatic heteropolycyclic compound
  • isoindole or derivatives
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • pyrrolidine
  • amine
  • tertiary amine
  • organoheterocyclic compound