Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:41:27 UTC
Update Date2025-03-25 00:47:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02159004
Frequency0.5
Structure
Chemical FormulaC9H12O5S
Molecular Mass232.0405
SMILESOCC1OC(c2sccc2O)C(O)C1O
InChI KeyZTSRGOGNKWBISY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • tetrahydrofurans
  • thiophenes
  • Substituents
  • alcohol
  • ether
  • aromatic heteromonocyclic compound
  • tetrahydrofuran
  • heteroaromatic compound
  • monosaccharide
  • thiophene
  • dialkyl ether
  • oxacycle
  • secondary alcohol
  • hydrocarbon derivative
  • primary alcohol
  • organoheterocyclic compound