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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:57:49 UTC
Update Date2025-03-25 00:52:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196200
Frequency0.5
Structure
Chemical FormulaC10H17NO5S
Molecular Mass263.0827
SMILESCC1=CCC2OC(C)(C)OC12COS(N)(=O)=O
InChI KeyTXBYBEUBFXRJKE-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
    • Substituents
  • meta-dioxolane
  • organic sulfuric acid or derivatives
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • ketal
  • hydrocarbon derivative
  • organic nitrogen compound
  • organoheterocyclic compound