Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:01:45 UTC
Update Date2025-03-25 00:54:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02205253
Frequency0.5
Structure
Chemical FormulaC6H13NO4S
Molecular Mass195.0565
SMILESNCC1(O)OC(CS)C(O)C1O
InChI KeySZNSHUKMBQRUBF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbohydrates and carbohydrate conjugates
Direct Parent monosaccharides
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • alkylthiols
  • hemiacetals
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • tetrahydrofuran
  • monosaccharide
  • organosulfur compound
  • oxacycle
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • secondary alcohol
  • organopnictogen compound
  • hemiacetal
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol
  • organoheterocyclic compound
  • 1,2-diol