Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:15 UTC
Update Date2025-03-21 18:41:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134608
Frequency18.7
Structure
Chemical FormulaC10H16O5
Molecular Mass216.0998
SMILESCCCCCC(O)=C(CC(=O)O)C(=O)O
InChI KeyKAPASFXWGVYQBN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classhydroxy acids and derivatives
Subclass medium-chain hydroxy acids and derivatives
Direct Parent medium-chain hydroxy acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • branched fatty acids
  • carbonyl compounds
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • hydroxy fatty acids
  • medium-chain fatty acids
  • organic oxides
  • unsaturated fatty acids
  • vinylogous acids
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • fatty acid
  • carboxylic acid derivative
  • branched fatty acid
  • medium-chain hydroxy acid
  • unsaturated fatty acid
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • medium-chain fatty acid
  • hydroxy fatty acid
  • organooxygen compound