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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:36 UTC
Update Date2025-03-25 00:56:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221262
Frequency0.5
Structure
Chemical FormulaC10H11NO5
Molecular Mass225.0637
SMILESO=C(O)CC(NC(=O)O)c1ccc(O)cc1
InChI KeyWQYLKZYRCARTLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classphenylpropanoic acids
Subclass phenylpropanoic acids
Direct Parent phenylpropanoic acids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbamic acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • carbonic acid derivative
  • carboxylic acid
  • 3-phenylpropanoic-acid
  • carbamic acid
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound