Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:59:27 UTC
Update Date2025-03-24 21:25:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01776236
Frequency0.7
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESO=C1CC1C(O)CO
InChI KeyPNURGXQYNZRFRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • cyclic ketones
  • hydrocarbon derivatives
  • organic oxides
  • primary alcohols
  • secondary alcohols
  • Substituents
  • carbonyl group
  • cyclic ketone
  • ketone
  • organic oxide
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • primary alcohol
  • 1,2-diol