Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 17:18:26 UTC
Update Date2025-03-25 01:47:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02521829
Frequency0.5
Structure
Chemical FormulaC5H6N2OS
Molecular Mass142.0201
SMILESCSc1[nH]cnc1C=O
InChI KeyGHHAGPNGUKEAOS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganosulfur compounds
Classthioethers
Subclass aryl thioethers
Direct Parent aryl thioethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • aryl-aldehydes
  • azacyclic compounds
  • carbonylimidazoles
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • sulfenyl compounds
  • vinylogous amides
  • vinylogous thioesters
  • Substituents
  • carbonyl group
  • aromatic heteromonocyclic compound
  • alkylarylthioether
  • aryl thioether
  • organic oxide
  • aryl-aldehyde
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • imidazole-4-carbonyl group
  • organoheterocyclic compound
  • azole
  • vinylogous thioester
  • vinylogous amide
  • sulfenyl compound
  • azacycle
  • heteroaromatic compound
  • aldehyde
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound