Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:03:48 UTC
Update Date2025-03-25 01:41:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02488131
Frequency0.5
Structure
Chemical FormulaC5H11N3O
Molecular Mass129.0902
SMILESCCC(=NC(=N)N)OC
InChI KeyBUQULBJQEYGQPV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboximidic acids and derivatives
Subclass imidoesters
Direct Parent imidoesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carboximidamides
  • hydrocarbon derivatives
  • imines
  • organooxygen compounds
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • aliphatic acyclic compound
  • imine
  • organic 1,3-dipolar compound
  • carboximidamide
  • imido ester
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound