Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:39:48 UTC
Update Date2025-03-21 17:58:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00014972
Frequency486.1
Structure
Chemical FormulaC4H6N2O2
Molecular Mass114.0429
SMILESO=C(O)C1CN=CN1
InChI KeyYPXMNQUCQFBNRH-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
  • carboximidamides
  • carboxylic acids
  • formamidines
  • hydrocarbon derivatives
  • imidazolines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • propargyl-type 1,3-dipolar organic compounds
  • Substituents
  • carbonyl group
  • carboxylic acid
  • azacycle
  • organic 1,3-dipolar compound
  • amidine
  • carboximidamide
  • propargyl-type 1,3-dipolar organic compound
  • formamidine
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • 2-imidazoline
  • imidazoline
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound