Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:56 UTC
Update Date2025-03-21 18:37:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00117479
Frequency22.3
Structure
Chemical FormulaC11H11NO4
Molecular Mass221.0688
SMILESO=C(Cc1ccccc1)NCC(=O)C(=O)O
InChI KeyCGMHWTCJWFWNBO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxamide group
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • keto acid
  • organonitrogen compound
  • alpha-keto acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenylacetamide
  • organooxygen compound