Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:34:51 UTC
Update Date2025-03-25 01:29:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02420002
Frequency0.5
Structure
Chemical FormulaC7H8N2O
Molecular Mass136.0637
SMILESN=Cc1cccc(O)c1N
InChI KeyCOGRSXUVUPWESU-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
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary amines
  • Substituents
  • carbonyl group
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • organooxygen compound