Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:59:37 UTC
Update Date2025-03-25 00:53:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02200408
Frequency0.5
Structure
Chemical FormulaC15H16N4
Molecular Mass252.1375
SMILESN=C(N)NCCc1c[nH]c2cc3ccccc3cc12
InChI KeyXSOGOIJTNRIOEE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthalenes
Direct Parent naphthalenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • guanidines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • indoles
  • organopnictogen compounds
  • pyrroles
  • Substituents
  • azacycle
  • indole
  • guanidine
  • imine
  • heteroaromatic compound
  • indole or derivatives
  • carboximidamide
  • naphthalene
  • aromatic heteropolycyclic compound
  • pyrrole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound