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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:23 UTC
Update Date2025-03-25 00:55:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213818
Frequency0.5
Structure
Chemical FormulaC12H17NO3
Molecular Mass223.1208
SMILESCCN(CC)C(=O)C(O)c1ccccc1O
InChI KeyPIDHKSKIJAMWIB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • aromatic alcohols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary alcohols
  • tertiary carboxylic acid amides
  • Substituents
  • aromatic alcohol
  • alcohol
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenylacetamide
  • organooxygen compound