Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:16:54 UTC
Update Date2025-03-25 00:59:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02239871
Frequency0.5
Structure
Chemical FormulaC5H8N2OS
Molecular Mass144.0357
SMILESNCCc1c[nH]c(=S)o1
InChI KeyQGFOKRMTILVIGL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • monoalkylamines
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • organosulfur compounds
  • oxacyclic compounds
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • oxazole
  • organosulfur compound
  • oxacycle
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • organooxygen compound