Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:34:38 UTC
Update Date2025-03-24 21:41:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01859762
Frequency0.7
Structure
Chemical FormulaC6H12OS
Molecular Mass132.0609
SMILESC=CCC(O)CCS
InChI KeyIGMZLMIHLZZGJX-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