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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:44:15 UTC
Update Date2025-03-25 00:47:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02165308
Frequency0.5
Structure
Chemical FormulaC13H17NO5
Molecular Mass267.1107
SMILESCC1OC(Oc2ccc(CC(N)=O)cc2)C(O)C1O
InChI KeyOEQKZVXNDIWFBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylacetamides
Direct Parent phenylacetamides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • acetals
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • phenol ethers
  • phenoxy compounds
  • primary carboxylic acid amides
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • primary carboxylic acid amide
  • phenol ether
  • carbonyl group
  • aromatic heteromonocyclic compound
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • acetal
  • organonitrogen compound
  • organopnictogen compound
  • phenylacetamide
  • organoheterocyclic compound
  • 1,2-diol
  • alcohol
  • tetrahydrofuran
  • carboxamide group
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound