Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:27 UTC
Update Date2025-03-21 18:38:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123385
Frequency20.9
Structure
Chemical FormulaC10H13NO4
Molecular Mass211.0845
SMILESNC(Cc1ccc(O)c(O)c1)C(=O)CO
InChI KeyGKBFNMDJXKFOGA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alcohols and polyols
  • alpha-hydroxy ketones
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • monosaccharide
  • 1-hydroxy-4-unsubstituted benzenoid
  • alpha-hydroxy ketone
  • ketone
  • aromatic homomonocyclic compound
  • saccharide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound
  • amphetamine or derivatives