Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:26 UTC
Update Date2025-03-21 18:38:58 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00123361
Frequency20.9
Structure
Chemical FormulaC4H9NO5S
Molecular Mass183.0201
SMILESCC(CNS(=O)(=O)O)C(=O)O
InChI KeyNLPXVNVBYCJFHB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent beta amino acids and derivatives
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfuric acid monoamides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organic sulfuric acid or derivatives
  • beta amino acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • organonitrogen compound
  • sulfuric acid monoamide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound