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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:09 UTC
Update Date2025-03-25 01:00:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02245128
Frequency0.5
Structure
Chemical FormulaC9H20N4O2
Molecular Mass216.1586
SMILESCN=C(NC)NCCCCC(=O)C(N)O
InChI KeyHVERXMCGHDQZLI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkanolamines
  • alpha-hydroxy ketones
  • carboximidamides
  • guanidines
  • hydrocarbon derivatives
  • imines
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • guanidine
  • imine
  • monosaccharide
  • organic 1,3-dipolar compound
  • carboximidamide
  • alpha-hydroxy ketone
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkanolamine