Hmdb loader

Showing information for DMID02229839

Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:29 UTC
Update Date2025-03-25 00:58:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02229839
Frequency0.5
Structure
Chemical FormulaC10H18O2S
Molecular Mass202.1028
SMILESCCCC=CCC(CC(=O)O)SC
InChI KeyUHQQBHVPNJCPID-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent medium-chain fatty acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dialkylthioethers
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • sulfenyl compounds
  • thia fatty acids
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • sulfenyl compound
  • dialkylthioether
  • organosulfur compound
  • carboxylic acid derivative
  • organic oxide
  • monocarboxylic acid or derivatives
  • thia fatty acid
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • medium-chain fatty acid
  • organooxygen compound