Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:01:51 UTC
Update Date2025-03-21 18:07:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00066562
Frequency45.8
Structure
Chemical FormulaC4H6O2S
Molecular Mass118.0088
SMILESO=C(O)C1CCS1
InChI KeyDXLJRXNSXUMGMK-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
  • dialkylthioethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • dialkylthioether
  • thietane
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • thioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound