Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:23:06 UTC
Update Date2025-03-21 20:54:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00397779
Frequency4.6
Structure
Chemical FormulaC4H12O2S
Molecular Mass124.0558
SMILESC[SH](C)(=O)CCO
InChI KeyAMVXHYVVONFZEL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alcohols and polyols
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol
  • organooxygen compound