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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:49 UTC
Update Date2025-03-21 18:28:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00073734
Frequency46.4
Structure
Chemical FormulaC9H13N3O2
Molecular Mass195.1008
SMILESN=C(N)NCC(O)c1ccc(O)cc1
InChI KeyKNTIWEBXZVEUPN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • aromatic alcohols
  • benzene and substituted derivatives
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • organopnictogen compounds
  • secondary alcohols
    • Substituents
  • aromatic alcohol
  • alcohol
  • monocyclic benzene moiety
  • guanidine
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboximidamide
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound