Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:21 UTC
Update Date2025-03-25 00:53:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02197410
Frequency0.5
Structure
Chemical FormulaC6H8O4S2
Molecular Mass207.9864
SMILESCC=C(SSCC(=O)O)C(=O)O
InChI KeyRTFHARQBTVHWDS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass dicarboxylic acids and derivatives
Direct Parent dicarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • organic disulfides
  • organic oxides
  • sulfenyl compounds
  • unsaturated fatty acids
  • Substituents
  • fatty acyl
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • fatty acid
  • organosulfur compound
  • unsaturated fatty acid
  • organic oxide
  • organic oxygen compound
  • organic disulfide
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • organooxygen compound