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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:15:21 UTC
Update Date2025-03-24 19:58:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01094601
Frequency1.3
Structure
Chemical FormulaC5H7N3O
Molecular Mass125.0589
SMILESCN1C(=N)C(N)=CC1=O
InChI KeyYVEGBFOMMMQTTM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolines
Subclass pyrrolines
Direct Parent pyrrolines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboximidamides
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • vinylogous amides
    • Substituents
  • vinylogous amide
  • carbonyl group
  • azacycle
  • carboximidamide
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • pyrroline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound