Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:53:31 UTC
Update Date2025-03-24 21:49:44 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01904000
Frequency0.6
Structure
Chemical FormulaC7H12S
Molecular Mass128.066
SMILESC=CCSC(C)=CC
InChI KeyCHSPFQZNLUUHNQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classallyl sulfur compounds
Subclass allyl sulfur compounds
Direct Parent allyl sulfur compounds
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • sulfenyl compounds
  • thioenol ethers
  • Substituents
  • aliphatic acyclic compound
  • thioenolether
  • sulfenyl compound
  • allyl sulfur compound
  • hydrocarbon derivative