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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:31 UTC
Update Date2025-03-21 18:30:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082619
Frequency68.0
Structure
Chemical FormulaC7H16N4O
Molecular Mass172.1324
SMILESCN=C(NC)NCCCC(=N)O
InChI KeyPHPAEVLYZGRQJQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • carboximidic acids
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • carboximidic acid
  • guanidine
  • imine
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound