Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:22:39 UTC
Update Date2025-03-24 14:18:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00825123
Frequency1.8
Structure
Chemical FormulaC5H6N2OS
Molecular Mass142.0201
SMILESCS(=O)c1ccncn1
InChI KeyLEGJRLXMYHVXFF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdiazines
Subclass pyrimidines and pyrimidine derivatives
Direct Parent pyrimidines and pyrimidine derivatives
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfinyl compounds
  • sulfoxides
  • Substituents
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • organosulfur compound
  • pyrimidine
  • organic oxide
  • organic oxygen compound
  • sulfinyl compound
  • organonitrogen compound
  • sulfoxide
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound