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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:31:03 UTC
Update Date2025-03-25 00:43:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02135176
Frequency0.6
Structure
Chemical FormulaC5H8N4O
Molecular Mass140.0698
SMILESNC(=O)C1=C(N)NC=NC1
InChI KeyHIZWRKTWFUTWHH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous amides
Subclass vinylogous amides
Direct Parent vinylogous amides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • formamidines
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • primary carboxylic acid amides
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • primary carboxylic acid amide
  • vinylogous amide
  • carbonyl group
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • carboxamide group
  • carboxylic acid derivative
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound