Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:51 UTC
Update Date2025-03-25 00:56:15 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02217174
Frequency0.5
Structure
Chemical FormulaC11H14N2O3
Molecular Mass222.1004
SMILESNCC(=O)CCC(=O)Nc1ccc(O)cc1
InChI KeyDFSDKCAICXEGES-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent delta amino acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • anilides
  • carboxylic acids and derivatives
  • fatty amides
  • hydrocarbon derivatives
  • ketones
  • monoalkylamines
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • fatty amide
  • 1-hydroxy-2-unsubstituted benzenoid
  • n-arylamide
  • carboxamide group
  • ketone
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • delta amino acid or derivatives
  • hydrocarbon derivative
  • benzenoid
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound