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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:06 UTC
Update Date2025-03-25 01:00:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245032
Frequency0.5
Structure
Chemical FormulaC11H15N7O
Molecular Mass261.1338
SMILESCN1CCN(c2ncc3c(=O)[nH]c(N)nc3n2)CC1
InChI KeyZALKVDXJABNJND-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent n-arylpiperazines
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aminopyrimidines and derivatives
  • azacyclic compounds
  • dialkylarylamines
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • lactams
  • n-methylpiperazines
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • primary amines
  • pyrimidones
  • trialkylamines
    • Substituents
  • lactam
  • pyrimidone
  • pyrimidine
  • organic oxide
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • azacycle
  • n-alkylpiperazine
  • heteroaromatic compound
  • tertiary aliphatic amine
  • n-methylpiperazine
  • aminopyrimidine
  • organic oxygen compound
  • hydrocarbon derivative
  • primary amine
  • organic nitrogen compound
  • amine
  • n-arylpiperazine
  • organooxygen compound