Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:31:08 UTC
Update Date2025-03-21 18:41:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00136641
Frequency18.3
Structure
Chemical FormulaC7H13NO6S
Molecular Mass239.0464
SMILESCC1(C)OC2OCC2(COS(N)(=O)=O)O1
InChI KeyAKWDXDJXORCMRT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass ethers
Direct Parent ketals
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxolanes
  • hydrocarbon derivatives
  • organic nitrogen compounds
  • organic oxides
  • organic sulfuric acids and derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxetanes
  • Substituents
  • meta-dioxolane
  • organic sulfuric acid or derivatives
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • ketal
  • oxetane
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound