Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:46:26 UTC
Update Date2025-03-21 18:50:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00172701
Frequency13.5
Structure
Chemical FormulaC2H3NO3S
Molecular Mass120.9834
SMILESO=NSCC(=O)O
InChI KeyGWLFFJKFPZWJKP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass organic nitroso compounds
Direct Parent nitrosothiols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic nitrogen compounds
  • organic oxides
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • organosulfur compound
  • carboxylic acid derivative
  • nitrosothiol
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound
  • nitrosothiol-group