Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:34:03 UTC
Update Date2025-03-24 21:41:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01858353
Frequency0.7
Structure
Chemical FormulaC3H4O2S2
Molecular Mass135.9653
SMILESCSC(=S)C(=O)O
InChI KeyNEQAUPCPFROQKN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarbodithioic acid esters
Subclass carbodithioic acid esters
Direct Parent carbodithioic acid esters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dithiocarboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • organosulfur compound
  • carboxylic acid derivative
  • carbodithioic ester
  • dithiocarboxylic acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • dithiocarboxylic acid or derivatives
  • organooxygen compound