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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:04 UTC
Update Date2025-03-21 18:37:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115335
Frequency22.8
Structure
Chemical FormulaC15H18N2O2
Molecular Mass258.1368
SMILESCOc1ccc2[nH]cc(CCN3CCCC3=O)c2c1
InChI KeyMEZYFVJATJMAJE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrroles
  • pyrrolidine-2-ones
  • tertiary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • phenol ether
  • carbonyl group
  • ether
  • lactam
  • indole
  • alkyl aryl ether
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • tertiary carboxylic acid amide
  • organonitrogen compound
  • organopnictogen compound
  • pyrrolidine
  • pyrrolidone
  • azacycle
  • n-alkylpyrrolidine
  • heteroaromatic compound
  • carboxamide group
  • organic oxygen compound
  • anisole
  • pyrrole
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • organooxygen compound