Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:40:37 UTC
Update Date2025-03-24 20:25:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01444378
Frequency0.9
Structure
Chemical FormulaC4H7NOS
Molecular Mass117.0248
SMILESCC(=O)C1NCS1
InChI KeyVYDUIQJLJBCGAT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiazetidines
Subclass thiazetidines
Direct Parent thiazetidines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • dialkylamines
  • dialkylthioethers
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • organopnictogen compounds
  • Substituents
  • secondary aliphatic amine
  • carbonyl group
  • azacycle
  • dialkylthioether
  • 1,3-thiazetidine
  • secondary amine
  • ketone
  • organic oxide
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine