Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:48:21 UTC
Update Date2025-03-21 21:58:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00457693
Frequency3.8
Structure
Chemical FormulaC4H6N2O
Molecular Mass98.048
SMILESO=C1CNC=CN1
InChI KeyRWMBKMMQEMUWEO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylamines
  • hydrocarbon derivatives
  • lactams
  • organic oxides
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • lactam
  • azacycle
  • secondary amine
  • carboxamide group
  • secondary carboxylic acid amide
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound
  • amine