Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:07 UTC
Update Date2025-03-25 00:49:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02176504
Frequency0.5
Structure
Chemical FormulaC12H18N2O
Molecular Mass206.1419
SMILESCN(C)C1CCc2cc(N)c(O)cc2C1
InChI KeyLDTWEDJGTPCSEO-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
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • trialkylamines
  • Substituents
  • tetralin
  • tertiary aliphatic amine
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homopolycyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound