Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:02:30 UTC
Update Date2025-03-24 21:00:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01639703
Frequency0.8
Structure
Chemical FormulaC4H7NO4
Molecular Mass133.0375
SMILESCON=C(CO)C(=O)O
InChI KeyRQWJBBNNWXMCJK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass beta hydroxy acids and derivatives
Direct Parent beta hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • beta-hydroxy acid
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound