Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:51 UTC
Update Date2025-03-25 00:46:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02153136
Frequency0.5
Structure
Chemical FormulaC6H12O3S2
Molecular Mass196.0228
SMILESC=CCSCCCS(=O)(=O)O
InChI KeyGSHBKZLTRKGXMB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organosulfonic acids and derivatives
Direct Parent organosulfonic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • allyl sulfur compounds
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • sulfenyl compounds
  • sulfonyls
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • dialkylthioether
  • organosulfonic acid
  • allyl sulfur compound
  • organosulfur compound
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative