Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:50:33 UTC
Update Date2025-03-21 18:02:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00039823
Frequency87.1
Structure
Chemical FormulaC11H15N3O
Molecular Mass205.1215
SMILESCOc1ccc2c(c1)CN(C(=N)N)CC2
InChI KeyWINDTXDUHQAZJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • Substituents
  • phenol ether
  • ether
  • azacycle
  • guanidine
  • imine
  • carboximidamide
  • alkyl aryl ether
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • anisole
  • organonitrogen compound
  • tetrahydroisoquinoline
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound