Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:37:31 UTC
Update Date2025-03-25 00:45:34 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02149978
Frequency0.5
Structure
Chemical FormulaC9H19NO3S
Molecular Mass221.1086
SMILESCCN(CC)C(=O)S(=O)C(O)C(C)C
InChI KeyHUSMZKNXOQYBDK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiolactones
Subclass thiolactones
Direct Parent thiolactones
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic carbonic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carbonic acid derivative
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiolactone
  • organooxygen compound