Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:30:03 UTC
Update Date2025-03-21 18:41:25 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00134174
Frequency18.8
Structure
Chemical FormulaC12H20S
Molecular Mass196.1286
SMILESCSC=C(C)CCC1C=CCCC1
InChI KeyMSFHWQRPVWYDBY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass thioenol ethers
Direct Parent thioenol ethers
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • thioenolether
  • sulfenyl compound
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative