Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:04:54 UTC
Update Date2025-03-25 00:55:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02212740
Frequency0.5
Structure
Chemical FormulaC16H28O3S
Molecular Mass300.1759
SMILESCCCCCC=CCC=CCC=CCCCS(=O)(=O)O
InChI KeyMFOHFNHFIGADHK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classorganic sulfonic acids and derivatives
Subclass organosulfonic acids and derivatives
Direct Parent organosulfonic acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic oxides
  • sulfonyls
  • Substituents
  • aliphatic acyclic compound
  • organic oxide
  • sulfonyl
  • organic oxygen compound
  • organosulfonic acid
  • hydrocarbon derivative
  • organosulfur compound