Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:01:45 UTC
Update Date2025-03-24 19:51:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01061655
Frequency1.3
Structure
Chemical FormulaC4H4O3S
Molecular Mass131.9881
SMILESO=C(O)C(=O)CC=S
InChI KeyGKHNSEPMQHFIPO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classketo acids and derivatives
Subclass short-chain keto acids and derivatives
Direct Parent short-chain keto acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alpha-hydroxy ketones
  • alpha-keto acids and derivatives
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • thioaldehydes
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • thiocarbonyl group
  • short-chain keto acid
  • organosulfur compound
  • alpha-hydroxy ketone
  • carboxylic acid derivative
  • ketone
  • organic oxide
  • monocarboxylic acid or derivatives
  • thioaldehyde
  • organic oxygen compound
  • alpha-keto acid
  • hydrocarbon derivative
  • organooxygen compound