Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:18:32 UTC
Update Date2025-03-25 01:47:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02522058
Frequency0.5
Structure
Chemical FormulaC9H7NO+
Molecular Mass145.0522
SMILESOc1cccc2c1=C[N+]=CC=2
InChI KeyZHGPESWVTPJQRB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzenoids
  • hydrocarbon derivatives
  • imines
  • organic cations
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • azacycle
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organoheterocyclic compound
  • organooxygen compound