Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:50:30 UTC
Update Date2025-03-25 00:50:14 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02179644
Frequency0.5
Structure
Chemical FormulaC6H11NOS
Molecular Mass145.0561
SMILESCSC1CCN(C)C1=O
InChI KeyFWUQERCBDMFUTL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrrolidines
Subclass pyrrolidones
Direct Parent pyrrolidine-2-ones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • lactams
  • n-alkylpyrrolidines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • tertiary carboxylic acid amides
  • Substituents
  • 2-pyrrolidone
  • carbonyl group
  • lactam
  • sulfenyl compound
  • azacycle
  • n-alkylpyrrolidine
  • dialkylthioether
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • thioether
  • tertiary carboxylic acid amide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound