Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:22:00 UTC
Update Date2025-03-21 18:37:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00115206
Frequency22.9
Structure
Chemical FormulaC8H13NOS
Molecular Mass171.0718
SMILESCCc1nc(C)c(CCO)s1
InChI KeyLEJKIGXZLKOOAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazoles
Subclass thiazoles
Direct Parent 2,4,5-trisubstituted thiazoles
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organonitrogen compounds
  • organopnictogen compounds
  • Substituents
  • alcohol
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • 2,4,5-trisubstituted 1,3-thiazole
  • organic oxygen compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound