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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:29 UTC
Update Date2025-03-25 00:57:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227682
Frequency0.5
Structure
Chemical FormulaC15H17NO3
Molecular Mass259.1208
SMILESCC(=O)N1CCC2(CC1)CC(=O)c1ccccc1O2
InChI KeyWFBMOLVHRVXRNG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classbenzopyrans
Subclass 1-benzopyrans
Direct Parent chromones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetamides
  • alkyl aryl ethers
  • aryl alkyl ketones
  • azacyclic compounds
  • benzenoids
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • n-acylpiperidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • tertiary carboxylic acid amides
    • Substituents
  • carbonyl group
  • ether
  • aryl alkyl ketone
  • alkyl aryl ether
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • chromone
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • piperidine
  • acetamide
  • azacycle
  • carboxamide group
  • oxacycle
  • n-acyl-piperidine
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound
  • aryl ketone