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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:24 UTC
Update Date2025-03-25 00:57:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02225298
Frequency0.5
Structure
Chemical FormulaC19H32N2O3
Molecular Mass336.2413
SMILESCC(C)(C)C(O)c1ccc(N2CCN(CCOCCO)CC2)cc1
InChI KeyDKNOQAIGKZSLSZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass piperazines
Direct Parent phenylpiperazines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aniline and substituted anilines
  • aromatic alcohols
  • azacyclic compounds
  • dialkyl ethers
  • dialkylarylamines
  • hydrocarbon derivatives
  • n-alkylpiperazines
  • n-arylpiperazines
  • organopnictogen compounds
  • phenylpropanes
  • secondary alcohols
  • trialkylamines
    • Substituents
  • aromatic alcohol
  • monocyclic benzene moiety
  • ether
  • aromatic heteromonocyclic compound
  • dialkyl ether
  • phenylpropane
  • tertiary aliphatic/aromatic amine
  • organonitrogen compound
  • organopnictogen compound
  • dialkylarylamine
  • tertiary amine
  • alcohol
  • azacycle
  • aniline or substituted anilines
  • n-alkylpiperazine
  • tertiary aliphatic amine
  • phenylpiperazine
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • organic nitrogen compound
  • amine
  • n-arylpiperazine
  • organooxygen compound