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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:15:16 UTC
Update Date2025-03-24 16:44:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00951026
Frequency1.5
Structure
Chemical FormulaC4H9N3O
Molecular Mass115.0746
SMILESCN=C(NC)NC=O
InChI KeyRDGROWFVOAVRHS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent guanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • guanidine
  • imine
  • organic 1,3-dipolar compound
  • carboximidamide
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organooxygen compound