Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:47:10 UTC
Update Date2025-03-25 00:49:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02171965
Frequency0.5
Structure
Chemical FormulaC16H15NO3
Molecular Mass269.1052
SMILESCC(=O)NC(OC(=O)c1ccccc1)c1ccccc1
InChI KeyKRORVKJYUVNTIK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent benzoic acid esters
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • benzoyl derivatives
  • benzyloxycarbonyls
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • benzyloxycarbonyl
  • carbonyl group
  • benzoyl
  • benzoate ester
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound