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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:36 UTC
Update Date2025-03-25 01:00:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02246216
Frequency0.5
Structure
Chemical FormulaC11H15N5O
Molecular Mass233.1277
SMILESCC1(C)N=C(N)N=C(N)N1c1ccc(O)cc1
InChI KeySJSNBTUQKPFFQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,3,5-triazines
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • azacycle
  • guanidine
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • organonitrogen compound
  • triazine
  • organopnictogen compound
  • hydrocarbon derivative
  • 1,3,5-triazine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound