Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:59 UTC
Update Date2025-03-21 18:39:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124603
Frequency20.6
Structure
Chemical FormulaC12H13NO4
Molecular Mass235.0845
SMILESO=C(O)CCC(=O)NC(=O)Cc1ccccc1
InChI KeyPLMMWIATSYJYNC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dicarboximides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • n-acyl amines
  • n-unsubstituted carboxylic acid imides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • n-acyl-amine
  • carboxylic acid imide
  • aromatic homomonocyclic compound
  • carboxylic acid imide, n-unsubstituted
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • phenylacetamide
  • organooxygen compound