Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:41:54 UTC
Update Date2025-03-21 17:59:13 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00019575
Frequency208.6
Structure
Chemical FormulaC7H12OS2
Molecular Mass176.033
SMILESCC(=O)CCC1CCSS1
InChI KeyZPYXADOPVWLUSV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdithiolanes
Subclass 1,2-dithiolanes
Direct Parent 1,2-dithiolanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic disulfides
  • organic oxides
  • Substituents
  • ketone
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • organic disulfide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • 1,2-dithiolane
  • organooxygen compound