Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:55:24 UTC
Update Date2025-03-21 18:04:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00051393
Frequency63.6
Structure
Chemical FormulaC5H12O3
Molecular Mass120.0786
SMILESCCC(O)(CO)CO
InChI KeyPDAZMXUHGPNZOU-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
  • hydrocarbon derivatives
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative