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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:10 UTC
Update Date2025-03-25 00:57:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222578
Frequency0.5
Structure
Chemical FormulaC21H25N3O2
Molecular Mass351.1947
SMILESO=C1Nc2ccccc2C12CCN(CCCC(O)c1cccnc1)CC2
InChI KeyBZNQZAAKHOFXGO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classindoles and derivatives
Subclass indoles
Direct Parent indoles
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • amino acids and derivatives
  • aromatic alcohols
  • azacyclic compounds
  • benzenoids
  • carbonyl compounds
  • carboxylic acids and derivatives
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • indolines
  • lactams
  • organic oxides
  • organopnictogen compounds
  • piperidines
  • secondary alcohols
  • secondary carboxylic acid amides
  • trialkylamines
  • Substituents
  • aromatic alcohol
  • carbonyl group
  • lactam
  • amino acid or derivatives
  • indole
  • carboxylic acid derivative
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • dihydroindole
  • piperidine
  • tertiary amine
  • alcohol
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • hydroxypyridine
  • carboxamide group
  • secondary carboxylic acid amide
  • pyridine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • organooxygen compound