Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:22:11 UTC
Update Date2025-03-24 16:48:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00967825
Frequency1.5
Structure
Chemical FormulaC6H12OS
Molecular Mass132.0609
SMILESCSC=CC(C)(C)O
InChI KeyXNSNGIQRBAEOBU-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
  • hydrocarbon derivatives
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • aliphatic acyclic compound
  • tertiary alcohol
  • thioenolether
  • sulfenyl compound
  • hydrocarbon derivative
  • organosulfur compound