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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:28 UTC
Update Date2025-03-25 00:53:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202312
Frequency0.5
Structure
Chemical FormulaC28H59NO14+
Molecular Mass633.393
SMILESC[N+](CCOCCOCCOCCOCCOCCOCCOCCO)COCCOCCOCCOCCOCCO
InChI KeyPEBQCIBXJUGCRS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent hemiaminals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic cations
  • organonitrogen compounds
  • organopnictogen compounds
    • Substituents
  • alcohol
  • aliphatic acyclic compound
  • ether
  • dialkyl ether
  • hemiaminal
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound