Hmdb loader

Showing information for DMID02159185

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:32 UTC
Update Date2025-03-25 00:47:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159185
Frequency0.5
Structure
Chemical FormulaC12H13NO2
Molecular Mass203.0946
SMILESC=C(C)C(=O)c1ccccc1NC(C)=O
InChI KeyNDNPIOXYHPIBLG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent acetanilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • alpha-branched alpha,beta-unsaturated ketones
  • aryl ketones
  • benzoyl derivatives
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acetylarylamines
  • organic oxides
  • organopnictogen compounds
  • phenylpropanes
  • secondary carboxylic acid amides
  • vinylogous amides
    • Substituents
  • carbonyl group
  • n-acetylarylamine
  • benzoyl
  • n-arylamide
  • alpha,beta-unsaturated ketone
  • carboxylic acid derivative
  • ketone
  • phenylpropane
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • acetamide
  • alpha-branched alpha,beta-unsaturated-ketone
  • vinylogous amide
  • acetanilide
  • carboxamide group
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • aryl ketone