Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:50:17 UTC
Update Date2025-03-24 14:04:19 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00747309
Frequency2.0
Structure
Chemical FormulaC6H9NOS
Molecular Mass143.0405
SMILESCSc1nc(C)c(C)o1
InChI KeyXYLFVYPPRKQXKJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass oxazoles
Direct Parent 2,4,5-trisubstituted oxazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alkylarylthioethers
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • Substituents
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • alkylarylthioether
  • organosulfur compound
  • aryl thioether
  • oxacycle
  • organic oxygen compound
  • thioether
  • 2,4,5-trisubstituted 1,3-oxazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound