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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:14:01 UTC
Update Date2025-03-21 18:33:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00095640
Frequency29.0
Structure
Chemical FormulaC10H13N3O2
Molecular Mass207.1008
SMILESN=C(N)N1Cc2cc(O)ccc2C(O)C1
InChI KeyTXBFXPINGFFWSP-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
  • 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
  • organic nitrogen compound
  • organooxygen compound