Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:09:40 UTC
Update Date2025-03-25 00:57:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02223717
Frequency0.5
Structure
Chemical FormulaC5H9NO4
Molecular Mass147.0532
SMILESNC(C(=O)CO)C(=O)CO
InChI KeyKSJUAZMUTOCPNR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent beta-diketones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • alpha-hydroxy ketones
  • hydrocarbon derivatives
  • monoalkylamines
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • monosaccharide
  • alpha-hydroxy ketone
  • ketone
  • saccharide
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • 1,3-diketone