Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:10 UTC
Update Date2025-03-25 00:55:37 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213326
Frequency0.5
Structure
Chemical FormulaC13H18N2
Molecular Mass202.147
SMILESCN1CCC2c3ccccc3CC1N2C
InChI KeyWCBXJIGUACOZFU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzazocines
Direct Parent benzazocines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aminals
  • azacyclic compounds
  • benzenoids
  • diazinanes
  • hydrocarbon derivatives
  • organopnictogen compounds
  • tetrahydroisoquinolines
  • Substituents
  • azacycle
  • aminal
  • 1,3-diazinane
  • aromatic heteropolycyclic compound
  • benzazocine
  • organonitrogen compound
  • tetrahydroisoquinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound