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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:40:21 UTC
Update Date2025-03-25 00:46:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02156596
Frequency0.5
Structure
Chemical FormulaC7H10N2O3
Molecular Mass170.0691
SMILESO=C1CC2C(O)CCN2C(=O)N1
InChI KeyUSHKSOKJXJCGQY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidones
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • diazinanes
  • dicarboximides
  • hydrocarbon derivatives
  • n-acyl ureas
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • pyrrolidines
  • secondary alcohols
  • Substituents
  • alcohol
  • n-acyl urea
  • carbonyl group
  • carbonic acid derivative
  • azacycle
  • pyrimidone
  • carboxylic acid derivative
  • aliphatic heteropolycyclic compound
  • 1,3-diazinane
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hydrocarbon derivative
  • dicarboximide
  • organic nitrogen compound
  • pyrrolidine
  • ureide
  • organooxygen compound