Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:37 UTC
Update Date2025-03-21 18:31:18 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00085220
Frequency33.6
Structure
Chemical FormulaC7H12O7S
Molecular Mass240.0304
SMILESCC1(C)OC2COC2(COS(=O)(=O)O)O1
InChI KeyLACCNYTWVCJZKP-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
  • alkyl sulfates
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • oxacyclic compounds
  • oxetanes
  • sulfuric acid monoesters
  • Substituents
  • meta-dioxolane
  • sulfuric acid monoester
  • organic sulfuric acid or derivatives
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxide
  • ketal
  • alkyl sulfate
  • oxetane
  • sulfate-ester
  • hydrocarbon derivative
  • sulfuric acid ester
  • organoheterocyclic compound