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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:11:21 UTC
Update Date2025-03-24 19:56:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01084547
Frequency1.3
Structure
Chemical FormulaC6H8N2O2
Molecular Mass140.0586
SMILESCC(=O)C1=NCCNC1=O
InChI KeyJVYSMNZCIYFTHN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactams
Subclass lactams
Direct Parent lactams
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • ketimines
  • ketones
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • secondary carboxylic acid amides
    • Substituents
  • ketimine
  • carbonyl group
  • lactam
  • azacycle
  • imine
  • organic 1,3-dipolar compound
  • carboxamide group
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • ketone
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound