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 IDDMID02228786
Frequency0.5
Structure
Chemical FormulaC12H16N2O3
Molecular Mass236.1161
SMILESCC(=O)NC(COC(N)=O)Cc1ccccc1
InChI KeyDBTMAFBKARFMAA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenethylamines
Direct Parent amphetamines and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acetamides
  • benzene and substituted derivatives
  • carbamate esters
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • carbonyl group
  • carbonic acid derivative
  • carbamic acid ester
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound
  • amphetamine or derivatives