Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:34:40 UTC
Update Date2025-03-21 22:50:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00567615
Frequency2.9
Structure
Chemical FormulaC4H9NOS
Molecular Mass119.0405
SMILESNC(CS)CC=O
InChI KeyHEBGQOADUYUQET-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • alkylthiols
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • Substituents
  • aliphatic acyclic compound
  • organosulfur compound
  • organic oxide
  • alpha-hydrogen aldehyde
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • alkylthiol