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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:32:03 UTC
Update Date2025-03-21 18:42:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00138787
Frequency18.0
Structure
Chemical FormulaC6H10N2O2
Molecular Mass142.0742
SMILESCC(O)C(=O)C1=NCNC1
InChI KeyYXVZNTJNAHSDNK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent acyloins
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • hydrocarbon derivatives
  • imidazolines
  • ketimines
  • ketones
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary alcohols
    • Substituents
  • ketimine
  • imine
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organoheterocyclic compound
  • alcohol
  • secondary aliphatic amine
  • azacycle
  • organic 1,3-dipolar compound
  • secondary amine
  • imidazoline
  • acyloin
  • secondary alcohol
  • 3-imidazoline
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine