Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:26 UTC
Update Date2025-03-25 00:48:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168018
Frequency0.5
Structure
Chemical FormulaC8H16O4S2
Molecular Mass240.049
SMILESCC(CSCC(O)C(O)CS)C(=O)O
InChI KeyHLMFRRLFWAYMSC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • thioether
  • secondary alcohol
  • hydrocarbon derivative
  • alkylthiol
  • 1,2-diol