Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:15:01 UTC
Update Date2025-03-21 18:33:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00098144
Frequency28.1
Structure
Chemical FormulaC12H20OS
Molecular Mass212.1235
SMILESCSC=C(C)CC1(O)C=CCC(C)C1
InChI KeyVGCZYLASCXATET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent tertiary alcohols
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • tertiary alcohol
  • thioenolether
  • sulfenyl compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organosulfur compound