Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:19:02 UTC
Update Date2025-03-25 00:39:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02107203
Frequency0.6
Structure
Chemical FormulaC2H3N3OS
Molecular Mass116.9997
SMILES[O-][n+]1c[nH]c(=S)[nH]1
InChI KeyCHYLPIRUTKGAKO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass triazoles
Direct Parent triazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • thioureas
  • Substituents
  • triazole
  • thiourea
  • aromatic heteromonocyclic compound
  • 1,2,4-triazole
  • azacycle
  • heteroaromatic compound
  • organosulfur compound
  • organic oxide
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound