Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:33:27 UTC
Update Date2025-03-21 18:45:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00142051
Frequency17.4
Structure
Chemical FormulaC3H7NOS
Molecular Mass105.0248
SMILESCSC(=O)CN
InChI KeyLOPGOIYYFSYQND-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
  • carbonyl compounds
  • carbothioic s-esters
  • carboxylic acids and derivatives
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • thioesters
  • thiolactones
  • Substituents
  • aliphatic acyclic compound
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • sulfenyl compound
  • thiocarboxylic acid ester
  • organosulfur compound
  • carbothioic s-ester
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • thiolactone
  • organooxygen compound