Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:36 UTC
Update Date2025-03-25 00:52:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02195719
Frequency0.5
Structure
Chemical FormulaC6H12O3S
Molecular Mass164.0507
SMILESCC1CS(=O)(=O)CC1(C)O
InChI KeyZEXFKYNJFBTQFX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolanes
Subclass thiolanes
Direct Parent thiolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • sulfones
  • tertiary alcohols
  • Substituents
  • thiolane
  • alcohol
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound
  • sulfone