Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:52 UTC
Update Date2025-03-25 00:52:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196317
Frequency0.5
Structure
Chemical FormulaC7H12OS
Molecular Mass144.0609
SMILESCC1=C(CO)CCSC1
InChI KeyJAHVAPBCMJSOOD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classthiopyrans
Subclass thiopyrans
Direct Parent thiopyrans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkylthioethers
  • hydrocarbon derivatives
  • Substituents
  • alcohol
  • organic oxygen compound
  • thioether
  • dialkylthioether
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • thiopyran
  • organooxygen compound