Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:19:37 UTC
Update Date2025-03-25 00:14:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01251296
Frequency1.1
Structure
Chemical FormulaC4H9NO2S
Molecular Mass135.0354
SMILESCS(=N)CCC(=O)O
InChI KeyRKUQMZJMKXJVJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids
Direct Parent carboxylic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic nitrogen compounds
  • organic oxides
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organic oxide
  • monocarboxylic acid or derivatives
  • carboxylic acid
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organosulfur compound
  • organooxygen compound