Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:08:24 UTC
Update Date2025-03-21 18:30:29 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00082362
Frequency35.1
Structure
Chemical FormulaC8H16N3OS+
Molecular Mass202.1009
SMILESC[N+](C)(C)C(O)Cc1c[nH]c(=S)[nH]1
InChI KeyXHJJXEGCCBAMHI-UHFFFAOYSA-O
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass imidazolines
Direct Parent imidazolethiones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • hemiaminals
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organic cations
  • organic salts
  • organonitrogen compounds
  • organooxygen compounds
  • organopnictogen compounds
  • tetraalkylammonium salts
  • thioureas
  • Substituents
  • thiourea
  • tetraalkylammonium salt
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • imidazole-2-thione
  • organosulfur compound
  • hemiaminal
  • organic oxygen compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organic cation
  • organic salt
  • organooxygen compound
  • alkanolamine
  • azole