Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:59:45 UTC
Update Date2025-03-21 18:06:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00061631
Frequency50.5
Structure
Chemical FormulaC11H19NO9S
Molecular Mass341.0781
SMILESCC1(C)OC2COC3(COS(N)(=O)=O)OC(CO)OC3C2O1
InChI KeyWQJWLELLYZNGIO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxolopyrans
Subclass dioxolopyrans
Direct Parent dioxolopyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • ketals
  • monosaccharides
  • organic nitrogen compounds
  • organic oxides
  • organic sulfuric acids and derivatives
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • Substituents
  • alcohol
  • meta-dioxolane
  • organic sulfuric acid or derivatives
  • monosaccharide
  • aliphatic heteropolycyclic compound
  • oxacycle
  • saccharide
  • organic oxide
  • organic oxygen compound
  • acetal
  • ketal
  • hydrocarbon derivative
  • organic nitrogen compound
  • oxane
  • primary alcohol
  • dioxolopyran
  • organooxygen compound