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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:20:32 UTC
Update Date2025-03-25 01:01:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02248328
Frequency0.5
Structure
Chemical FormulaC10H14N4O2
Molecular Mass222.1117
SMILESN=C(N)N1Cc2cc(N)c(O)cc2C(O)C1
InChI KeySCFQMDXEGQISHW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydroisoquinolines
Subclass tetrahydroisoquinolines
Direct Parent tetrahydroisoquinolines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • primary amines
  • secondary alcohols
    • Substituents
  • alcohol
  • azacycle
  • guanidine
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboximidamide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • tetrahydroisoquinoline
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • benzenoid
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound