Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:33 UTC
Update Date2025-03-21 17:58:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00012118
Frequency376.8
Structure
Chemical FormulaC5H6O5
Molecular Mass146.0215
SMILESO=C(O)C=C(CO)C(=O)O
InChI KeySTHTXXUMGAISCI-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
  • branched fatty acids
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • organic oxides
  • short-chain hydroxy acids and derivatives
  • unsaturated fatty acids
  • Substituents
  • alcohol
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • short-chain hydroxy acid
  • fatty acid
  • carboxylic acid derivative
  • branched fatty acid
  • unsaturated fatty acid
  • beta-hydroxy acid
  • organic oxide
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • hydroxy fatty acid
  • organooxygen compound