Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:44:20 UTC
Update Date2025-03-21 18:00:06 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00025079
Frequency154.3
Structure
Chemical FormulaC7H9NO3
Molecular Mass155.0582
SMILESNCc1cc(O)c(O)cc1O
InChI KeyBHUFLVAXHNGAPA-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
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound