Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:16:56 UTC
Update Date2025-03-21 18:34:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00102831
Frequency26.4
Structure
Chemical FormulaC6H10O2S2
Molecular Mass178.0122
SMILESO=C(O)CC1CCSSC1
InChI KeyABGLTWRKJOJNLD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acids and conjugates
Direct Parent thia fatty acids
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acids
  • dithianes
  • fatty acyls
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic disulfides
  • organic oxides
  • Substituents
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • 1,2-dithiane
  • organic oxide
  • monocarboxylic acid or derivatives
  • thia fatty acid
  • organic oxygen compound
  • organic disulfide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound