Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:30:38 UTC
Update Date2025-03-24 20:21:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01420760
Frequency0.9
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESCC1=C(C(N)=O)SCC1
InChI KeyFHOXTEKLXQUYQU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrothiophenes
Subclass dihydrothiophenes
Direct Parent dihydrothiophenes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • primary carboxylic acid amides
  • thioenol ethers
  • Substituents
  • primary carboxylic acid amide
  • carbonyl group
  • 2,3-dihydrothiophene
  • carboxamide group
  • carboxylic acid derivative
  • organic oxide
  • thioenolether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound