Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:12 UTC
Update Date2025-03-25 00:51:36 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02188104
Frequency0.5
Structure
Chemical FormulaC5H11NO2S
Molecular Mass149.051
SMILESCC(=O)NCSCCO
InChI KeyLTSJMIIAJJEOCH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthiohemiaminal derivatives
Subclass n,s-acetals
Direct Parent n,s-acetals
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • acetamides
  • alcohols and polyols
  • carbonyl compounds
  • carboxylic acids and derivatives
  • dialkylthioethers
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • secondary carboxylic acid amides
  • sulfenyl compounds
  • Substituents
  • alcohol
  • aliphatic acyclic compound
  • carbonyl group
  • sulfenyl compound
  • dialkylthioether
  • carboxamide group
  • carboxylic acid derivative
  • secondary carboxylic acid amide
  • n,s-acetal
  • organic oxide
  • organic oxygen compound
  • thioether
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • acetamide
  • organooxygen compound