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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:31 UTC
Update Date2025-03-25 00:46:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156952
Frequency0.5
Structure
Chemical FormulaC22H21NO
Molecular Mass315.1623
SMILESC=CC(=O)N1CCC(=C2c3ccccc3Cc3ccccc32)CC1
InChI KeyAVWVIKBQJDFWHJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classanthracenes
Subclass anthracenes
Direct Parent anthracenes
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acylpiperidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • tertiary carboxylic acid amides
    • Substituents
  • anthracene
  • carbonyl group
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • n-acyl-piperidine
  • organic oxide
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • piperidine
  • organoheterocyclic compound
  • organooxygen compound