Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:51:02 UTC
Update Date2025-03-25 00:50:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02180864
Frequency0.5
Structure
Chemical FormulaC10H14O8
Molecular Mass262.0689
SMILESO=C(O)CCC(O)(CCC(=O)O)C(=O)CC(=O)O
InChI KeyRXEXRLCWKJLSAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass tricarboxylic acids and derivatives
Direct Parent tricarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acyloins
  • alpha-hydroxy ketones
  • beta-hydroxy ketones
  • beta-keto acids and derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • tertiary alcohols
  • Substituents
  • alcohol
  • beta-hydroxy ketone
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • tricarboxylic acid or derivatives
  • alpha-hydroxy ketone
  • beta-keto acid
  • ketone
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • keto acid
  • acyloin
  • hydrocarbon derivative
  • organooxygen compound