Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:00 UTC
Update Date2025-03-25 00:58:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02228797
Frequency0.5
Structure
Chemical FormulaC11H13NO4
Molecular Mass223.0845
SMILESCC(=O)NC(Cc1ccccc1)OC(=O)O
InChI KeyIMOXBLWAAPITKA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • carbonic acid monoesters
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carbonic acid derivative
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • carbonic acid monoester
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound