Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:56:37 UTC
Update Date2025-03-21 18:05:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00054166
Frequency59.5
Structure
Chemical FormulaC12H17N3
Molecular Mass203.1422
SMILESCN(C)C(=N)N1CCc2ccccc2C1
InChI KeyIFKCQTHKKHKUDL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • benzenoids
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • Substituents
  • azacycle
  • guanidine
  • imine
  • carboximidamide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • tetrahydroisoquinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound