Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:07:51 UTC
Update Date2025-03-24 14:12:08 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00789392
Frequency1.9
Structure
Chemical FormulaC6H14OS
Molecular Mass134.0765
SMILESCC=CC[SH](C)(C)=O
InChI KeyLJRIMKROQMDEMO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiols
Subclass alkylthiols
Direct Parent alkylthiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • alkylthiol