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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:15:04 UTC
Update Date2025-03-25 00:59:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235779
Frequency0.5
Structure
Chemical FormulaC14H22N2O4
Molecular Mass282.158
SMILESCOc1ccc(NC(=O)CO)c(C(O)CCN(C)C)c1
InChI KeyXAIXOKAXLSKPSZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass anilides
Direct Parent anilides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1,3-aminoalcohols
  • alkyl aryl ethers
  • amino acids and derivatives
  • anisoles
  • aromatic alcohols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • methoxybenzenes
  • n-arylamides
  • organic oxides
  • organopnictogen compounds
  • phenoxy compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • phenol ether
  • carbonyl group
  • ether
  • amino acid or derivatives
  • n-arylamide
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • tertiary amine
  • alcohol
  • 1,3-aminoalcohol
  • tertiary aliphatic amine
  • carboxamide group
  • methoxybenzene
  • aromatic homomonocyclic compound
  • anilide
  • secondary carboxylic acid amide
  • organic oxygen compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • amine
  • organooxygen compound