Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:26 UTC
Update Date2025-03-21 17:59:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00018515
Frequency250.1
Structure
Chemical FormulaC10H11NO4
Molecular Mass209.0688
SMILESO=C(O)CCC(=O)Nc1ccccc1O
InChI KeyKHPAYIYVNRVFCK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • carbonyl compounds
  • carboxylic acids
  • fatty amides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • carbonyl group
  • carboxylic acid
  • fatty amide
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-arylamide
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound