Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:37:00 UTC
Update Date2025-03-24 17:53:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01002997
Frequency1.4
Structure
Chemical FormulaC5H12O4
Molecular Mass136.0736
SMILESCC(C)(O)C(O)(O)CO
InChI KeyWERBIMRJGOARDD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • 1,1-diols
  • carbonyl hydrates
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • carbonyl hydrate
  • hydrocarbon derivative
  • 1,1-diol