Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:52:54 UTC
Update Date2025-03-21 18:52:40 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00188052
Frequency12.1
Structure
Chemical FormulaC6H8O4
Molecular Mass144.0423
SMILESO=C1CCC(=O)C(O)C1O
InChI KeyKBHQLXWSKGNDGY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent cyclic alcohols and derivatives
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • 1,2-diols
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • cyclic alcohol
  • ketone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • 1,2-diol