Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 07:49:49 UTC
Update Date2025-03-24 22:23:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01177721
Frequency1.1
Structure
Chemical FormulaC4H7NOS
Molecular Mass117.0248
SMILESNC(=O)C1CCS1
InChI KeyUAXZIZHCQCSVTP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthietanes
Subclass thietanes
Direct Parent thietanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • dialkylthioether
  • thietane
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound