Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:01 UTC
Update Date2025-03-25 00:51:32 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187677
Frequency0.5
Structure
Chemical FormulaC4H10O5S
Molecular Mass170.0249
SMILESCC(C)C(=O)O[SH](=O)(O)O
InChI KeyNGJKRWCDHXQBKV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass monocarboxylic acids and derivatives
Direct Parent monocarboxylic acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound