Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:47 UTC
Update Date2025-03-21 18:39:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124131
Frequency20.7
Structure
Chemical FormulaC7H16O2S
Molecular Mass164.0871
SMILESCCCCC(O)C(O)CS
InChI KeyGAKHSVMFHXUSTA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass alcohols and polyols
Direct Parent 1,2-diols
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • organosulfur compounds
  • secondary alcohols
  • Substituents
  • aliphatic acyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organosulfur compound
  • alkylthiol
  • 1,2-diol