Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:37 UTC
Update Date2025-03-25 00:56:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221286
Frequency0.5
Structure
Chemical FormulaC13H11NO4
Molecular Mass245.0688
SMILESO=C(O)CC(=O)Nc1cc(O)cc2ccccc12
InChI KeyQPZDXKSYLNJQDS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classnaphthalenes
Subclass naphthols and derivatives
Direct Parent naphthols and derivatives
Geometric Descriptor aromatic homopolycyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-arylamide
  • aromatic homopolycyclic compound
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • 2-naphthol
  • organooxygen compound