Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:55:33 UTC
Update Date2025-03-24 20:57:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01622815
Frequency0.8
Structure
Chemical FormulaC5H10O2S
Molecular Mass134.0402
SMILESCCC(O)CC(O)=S
InChI KeyBZKZDJNWIWNMBJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent secondary alcohols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbodithioic acids
  • carbonyl compounds
  • carbothioic o-acids
  • hydrocarbon derivatives
  • thiocarbonyl compounds
  • thiocarboxylic acids and derivatives
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • thiocarbonyl group
  • carbodithioic acid
  • organosulfur compound
  • carbothioic o-acid
  • secondary alcohol
  • hydrocarbon derivative