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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:43 UTC
Update Date2025-03-25 00:45:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02150478
Frequency0.5
Structure
Chemical FormulaC22H20N2O3
Molecular Mass360.1474
SMILESC=CC1=C(C)C(=CC2=NC(=Cc3ccccc3O)C(C(C)=O)=C2C)NC1=O
InChI KeyPZUGXMSXWAXPBG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass 1-hydroxy-2-unsubstituted benzenoids
Direct Parent 1-hydroxy-2-unsubstituted benzenoids
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • 1-hydroxy-4-unsubstituted benzenoids
  • azacyclic compounds
  • benzene and substituted derivatives
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketimines
  • ketones
  • lactams
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • pyrrolines
  • secondary carboxylic acid amides
    • Substituents
  • ketimine
  • monocyclic benzene moiety
  • carbonyl group
  • lactam
  • aromatic heteromonocyclic compound
  • imine
  • 1-hydroxy-2-unsubstituted benzenoid
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • azacycle
  • organic 1,3-dipolar compound
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxygen compound
  • pyrroline
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound