Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:25 UTC
Update Date2025-03-25 00:55:43 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213900
Frequency0.5
Structure
Chemical FormulaC6H11NOS
Molecular Mass145.0561
SMILESCCNC(=O)C=CSC
InChI KeyJTMXIMIOZNVWLK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classvinylogous thioesters
Subclass vinylogous thioesters
Direct Parent vinylogous thioesters
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • vinylogous thioester
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • organosulfur compound
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound