Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:50:48 UTC
Update Date2025-03-25 00:28:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02040289
Frequency0.6
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCC1=C(C(C)O)SCC1
InChI KeyHXHXHBKCBVGWAV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrothiophenes
Subclass dihydrothiophenes
Direct Parent dihydrothiophenes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • secondary alcohols
  • thioenol ethers
  • Substituents
  • alcohol
  • thioenolether
  • organic oxygen compound
  • 2,3-dihydrothiophene
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound