Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:10:03 UTC
Update Date2025-03-25 00:57:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02224557
Frequency0.5
Structure
Chemical FormulaC10H14O7
Molecular Mass246.074
SMILESO=C(O)C(O)C1CCC(C(=O)O)(C(=O)O)CC1
InChI KeySTZKLBBASDJFTF-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 homomonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • alpha-hydroxy acid
  • tricarboxylic acid or derivatives
  • hydroxy acid
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound