Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:08:36 UTC
Update Date2025-03-24 22:31:04 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01224231
Frequency1.1
Structure
Chemical FormulaC6H14OS
Molecular Mass134.0765
SMILESCCC(O)C(C)CS
InChI KeyGOCOAXOZJQLVMI-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol