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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:02 UTC
Update Date2025-03-25 00:57:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02222248
Frequency0.5
Structure
Chemical FormulaC16H24N4O2
Molecular Mass304.1899
SMILESOCCOCCN1CCN(Cc2c[nH]c3ncccc23)CC1
InChI KeyRUZHNPSIPQNZDZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolopyridines
Subclass pyrrolopyridines
Direct Parent pyrrolopyridines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 2-halopyridines
  • alcohols and polyols
  • aralkylamines
  • azacyclic compounds
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • hydroxypyridines
  • n-alkylpiperazines
  • organopnictogen compounds
  • polyhalopyridines
  • pyrroles
  • trialkylamines
    • Substituents
  • ether
  • polyhalopyridine
  • dialkyl ether
  • aralkylamine
  • piperazine
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 2-halopyridine
  • tertiary amine
  • alcohol
  • azacycle
  • pyrrolopyridine
  • n-alkylpiperazine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • hydroxypyridine
  • pyridine
  • organic oxygen compound
  • 1,4-diazinane
  • pyrrole
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound