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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:15 UTC
Update Date2025-03-25 01:01:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02249967
Frequency0.5
Structure
Chemical FormulaC16H17NO4
Molecular Mass287.1158
SMILESCOc1cccc(CNC(=O)c2ccccc2O)c1OC
InChI KeyGWADSJVHZRTDNO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoic acids and derivatives
Direct Parent n-benzylbenzamides
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • benzoyl derivatives
  • carboxylic acids and derivatives
  • dimethoxybenzenes
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • salicylamides
  • secondary carboxylic acid amides
  • vinylogous acids
  • Substituents
  • phenol ether
  • ether
  • benzoyl
  • 1-hydroxy-2-unsubstituted benzenoid
  • alkyl aryl ether
  • carboxylic acid derivative
  • dimethoxybenzene
  • organic oxide
  • n-benzylbenzamide
  • o-dimethoxybenzene
  • organonitrogen compound
  • organopnictogen compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • methoxybenzene
  • salicylamide
  • aromatic homomonocyclic compound
  • secondary carboxylic acid amide
  • vinylogous acid
  • organic oxygen compound
  • salicylic acid or derivatives
  • anisole
  • phenol
  • hydrocarbon derivative
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound