Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:07:24 UTC
Update Date2025-03-21 18:29:52 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00079963
Frequency36.4
Structure
Chemical FormulaC9H18S
Molecular Mass158.1129
SMILESC=CCSCCCCCC
InChI KeyYNKIZMIPTRRCJC-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
  • dialkylthioethers
  • hydrocarbon derivatives
  • sulfenyl compounds
  • Substituents
  • aliphatic acyclic compound
  • sulfenyl compound
  • thioether
  • dialkylthioether
  • allyl sulfur compound
  • hydrocarbon derivative