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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:39:27 UTC
Update Date2025-03-25 00:46:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02154551
Frequency0.5
Structure
Chemical FormulaC18H17NO4
Molecular Mass311.1158
SMILESCOc1ccc(C2C(=O)C(=O)N(C)C2c2ccc(O)cc2)cc1
InChI KeyLFFOMKWACBZRLA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classstilbenes
Subclass stilbenes
Direct Parent stilbenes
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • carboxylic acids and derivatives
  • cyclic ketones
  • hydrocarbon derivatives
  • lactams
  • methoxybenzenes
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • phenoxy compounds
  • phenylpyrrolidines
  • pyrroles
  • pyrrolidine-2-ones
  • pyrrolidine-3-ones
  • tertiary carboxylic acid amides
    • Substituents
  • 2-pyrrolidone
  • phenol ether
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • lactam
  • aromatic heteromonocyclic compound
  • 3-pyrrolidone
  • 1-hydroxy-2-unsubstituted benzenoid
  • cyclic ketone
  • alkyl aryl ether
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • organoheterocyclic compound
  • azacycle
  • n-alkylpyrrolidine
  • 2-phenylpyrrolidine
  • carboxamide group
  • methoxybenzene
  • 3-phenylpyrrolidine
  • organic oxygen compound
  • anisole
  • pyrrole
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • phenoxy compound
  • organooxygen compound
  • stilbene