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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:38:29 UTC
Update Date2025-03-25 00:45:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02152273
Frequency0.5
Structure
Chemical FormulaC9H17NO7S
Molecular Mass283.0726
SMILESNC(CSC1OC(CO)C(O)(CO)C1O)C(=O)O
InChI KeyZLFFGRHUGXHRBM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent cysteine and derivatives
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha amino acids
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • monosaccharides
  • monothioacetals
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • primary alcohols
  • secondary alcohols
  • sulfenyl compounds
  • tertiary alcohols
  • tetrahydrofurans
  • Substituents
  • carbonyl group
  • carboxylic acid
  • monosaccharide
  • organosulfur compound
  • monothioacetal
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • primary alcohol
  • organoheterocyclic compound
  • alcohol
  • sulfenyl compound
  • tetrahydrofuran
  • oxacycle
  • tertiary alcohol
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • cysteine or derivatives
  • secondary alcohol
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound