Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:46:53 UTC
Update Date2025-03-24 20:28:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01458017
Frequency0.9
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCSCC(C)(O)C=O
InChI KeyDWWGRKSNZIWEIF-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
  • alpha-hydroxyaldehydes
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • dialkylthioether
  • aldehyde
  • organosulfur compound
  • tertiary alcohol
  • organic oxide
  • alpha-hydroxyaldehyde
  • thioether
  • hydrocarbon derivative