Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:51:52 UTC
Update Date2025-03-24 20:55:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01613798
Frequency0.8
Structure
Chemical FormulaC6H14OS
Molecular Mass134.0765
SMILESCCC(O)(CC)CS
InChI KeySLGYOUMXAQVPBA-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
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol