Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:46 UTC
Update Date2025-03-25 00:53:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02202993
Frequency0.5
Structure
Chemical FormulaC5H4O6
Molecular Mass160.0008
SMILESO=C1CC(O)(C(=O)O)C(=O)O1
InChI KeyHBBNGKDRTXZICD-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 heteromonocyclic compounds
Alternative Parents
  • alpha hydroxy acids and derivatives
  • carbonyl compounds
  • carboxylic acid anhydrides
  • carboxylic acids
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tertiary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • alpha-hydroxy acid
  • tricarboxylic acid or derivatives
  • hydroxy acid
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • carboxylic acid anhydride
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound