Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:43:43 UTC
Update Date2025-03-24 14:01:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00731500
Frequency2.1
Structure
Chemical FormulaC2H5NO3S
Molecular Mass122.999
SMILESNC([SH]=O)C(=O)O
InChI KeyMYEJPVXNYJQOFR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic acids and derivatives
Classcarboxylic acids and derivatives
Subclass amino acids, peptides, and analogues
Direct Parent alpha amino acids
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monoalkylamines
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • carboxylic acid
  • organosulfur compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol
  • organooxygen compound