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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:04 UTC
Update Date2025-03-25 00:46:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02155967
Frequency0.5
Structure
Chemical FormulaC9H23N6O+
Molecular Mass231.1928
SMILESC[N+](C)(C)C(O)CCCNC(=N)NC(=N)N
InChI KeyGKMICEJULKRHEO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent biguanides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • hemiaminals
  • hydrocarbon derivatives
  • imines
  • organic cations
  • organic salts
  • organooxygen compounds
  • organopnictogen compounds
  • tetraalkylammonium salts
    • Substituents
  • aliphatic acyclic compound
  • tetraalkylammonium salt
  • imine
  • carboximidamide
  • hemiaminal
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • biguanide
  • organic salt
  • organooxygen compound
  • alkanolamine