Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:08:31 UTC
Update Date2025-03-25 00:56:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02221063
Frequency0.5
Structure
Chemical FormulaC7H8O6
Molecular Mass188.0321
SMILESO=C1C(=O)C(O)C(O)=C1C(O)CO
InChI KeyXYXUITUGNXWFAX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous acids
Subclass vinylogous acids
Direct Parent vinylogous acids
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • cyclic ketone
  • ketone
  • vinylogous acid
  • organic oxide
  • organic oxygen compound
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • organooxygen compound