Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:00:04 UTC
Update Date2025-03-25 01:40:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02479474
Frequency0.5
Structure
Chemical FormulaC5H9N3O
Molecular Mass127.0746
SMILESNC1=NCC(CO)C=N1
InChI KeyKPMWHBDHNJHXFB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent hydropyrimidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboximidamides
  • hydrocarbon derivatives
  • organopnictogen compounds
  • primary alcohols
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • alcohol
  • azacycle
  • 5,6-dihydropyrimidine
  • organic 1,3-dipolar compound
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • hydropyrimidine
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • primary alcohol
  • organooxygen compound