Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:09:07 UTC
Update Date2025-03-21 18:31:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00084038
Frequency34.2
Structure
Chemical FormulaC7H13N3S
Molecular Mass171.083
SMILESCN(C)CCc1c[nH]c(=S)[nH]1
InChI KeyFJZSVIZURSVSOG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classazolines
Subclass imidazolines
Direct Parent imidazolethiones
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imidazoles
  • organopnictogen compounds
  • thioureas
  • trialkylamines
  • Substituents
  • thiourea
  • aromatic heteromonocyclic compound
  • azacycle
  • heteroaromatic compound
  • tertiary aliphatic amine
  • imidazole-2-thione
  • organosulfur compound
  • imidazole
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • azole