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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:15 UTC
Update Date2025-03-25 00:48:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169873
Frequency0.5
Structure
Chemical FormulaC5H13N3O2
Molecular Mass147.1008
SMILESCCOC(O)CN=C(N)N
InChI KeyRBNCGGZPUARBTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • hemiacetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • guanidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • organooxygen compound