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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:32 UTC
Update Date2025-03-25 00:47:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159166
Frequency0.5
Structure
Chemical FormulaC15H21N5O2
Molecular Mass303.1695
SMILESOCCOCCN1CCN(c2nnc3ccccc3n2)CC1
InChI KeyXEJXFWPZWKRIGR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent n-arylpiperazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • 1,2,4-triazines
  • alcohols and polyols
  • aminotriazines
  • azacyclic compounds
  • benzenoids
  • dialkyl ethers
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • n-alkylpiperazines
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • ether
  • dialkyl ether
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • alcohol
  • azacycle
  • aminotriazine
  • n-alkylpiperazine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organic oxygen compound
  • triazine
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • 1,2,4-triazine
  • amine
  • n-arylpiperazine
  • organooxygen compound