Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:59:01 UTC
Update Date2025-03-24 20:07:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01345059
Frequency1.0
Structure
Chemical FormulaC3H7NO2S
Molecular Mass121.0197
SMILESNCCS(=O)C=O
InChI KeyUDNMCLIVQDRDAK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • thiolactone
  • organooxygen compound