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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:42:18 UTC
Update Date2025-03-21 20:01:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00301768
Frequency6.6
Structure
Chemical FormulaC4H7N3O2
Molecular Mass129.0538
SMILESNC1NC(=O)CC(=O)N1
InChI KeySXOIKGKRIILVEP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazinanes
Subclass diazinanes
Direct Parent diazinanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • lactams
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • ortho amides
  • orthocarboxylic acid derivatives
  • secondary carboxylic acid amides
    • Substituents
  • carbonyl group
  • lactam
  • ortho amide
  • azacycle
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • orthocarboxylic acid derivative
  • organooxygen compound