Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:16:26 UTC
Update Date2025-03-24 21:06:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01673421
Frequency0.7
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESCC1=CC(=O)NSCC1
InChI KeyNFWUERDEGAHWOY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass carboxylic acids and derivatives
Direct Parent carboxylic acids and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • carbonyl compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • carbonyl group
  • azacycle
  • carboxylic acid derivative
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound
  • organooxygen compound