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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:38:40 UTC
Update Date2025-03-24 20:50:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01583292
Frequency0.8
Structure
Chemical FormulaC5H11N3O2
Molecular Mass145.0851
SMILESCCN(CC)C(=N)[N+](=O)[O-]
InChI KeyYCJHPQHDJFCVHD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent n-hydroxyguanidines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • c-nitro compounds
  • carboximidamides
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • aliphatic acyclic compound
  • imine
  • allyl-type 1,3-dipolar organic compound
  • organic 1,3-dipolar compound
  • carboximidamide
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • n-hydroxyguanidine
  • organic oxide
  • organic oxygen compound
  • c-nitro compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic oxoazanium
  • organic hyponitrite