Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:06:44 UTC
Update Date2025-03-25 01:42:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02494657
Frequency0.5
Structure
Chemical FormulaC4H8N2O2
Molecular Mass116.0586
SMILESCC(=O)OCC(=N)N
InChI KeyKBPKBTQPBJVAJA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acid derivatives
Direct Parent carboxylic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • amidines
  • carbonyl compounds
  • carboximidamides
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • amidine
  • carboximidamide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound