Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:46:38 UTC
Update Date2025-03-24 21:20:22 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01746281
Frequency0.7
Structure
Chemical FormulaC5H8N2OS
Molecular Mass144.0357
SMILESN=CNC1CCSC1=O
InChI KeyFZOMRMIVQXTVRZ-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 heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carbothioic s-lactones
  • carboximidamides
  • carboxylic acids and derivatives
  • formamidines
  • hydrocarbon derivatives
  • imines
  • organic oxides
  • organopnictogen compounds
  • thioesters
  • thiolactones
  • thiolanes
  • Substituents
  • thiolane
  • carbothioic s-lactone
  • thiocarboxylic acid or derivatives
  • carbonyl group
  • thiocarboxylic acid ester
  • imine
  • amidine
  • carboximidamide
  • formamidine
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • alpha-amino acid
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • thiolactone
  • organoheterocyclic compound
  • organooxygen compound