Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:17:38 UTC
Update Date2025-03-21 19:09:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00245185
Frequency8.6
Structure
Chemical FormulaC5H12O2S
Molecular Mass136.0558
SMILESCC(C)(O)C(O)CS
InChI KeyIDKKEBPOBHPAFK-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
  • 1,2-diols
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • secondary alcohols
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • secondary alcohol
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol
  • 1,2-diol