Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:03 UTC
Update Date2025-03-25 00:48:39 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02169399
Frequency0.5
Structure
Chemical FormulaC16H28N2OS3
Molecular Mass360.1364
SMILESCCCCCSC(=S)NCCSCc1ccc(CN(C)C)o1
InChI KeyCMLZMGZDIVDPKW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent aralkylamines
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • dialkylthioethers
  • dithiocarbamic acid esters
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • furan
  • sulfenyl compound
  • aromatic heteromonocyclic compound
  • dialkylthioether
  • heteroaromatic compound
  • tertiary aliphatic amine
  • organosulfur compound
  • aralkylamine
  • oxacycle
  • dithiocarbamic acid ester
  • organic oxygen compound
  • thioether
  • organopnictogen compound
  • hydrocarbon derivative
  • tertiary amine
  • organoheterocyclic compound
  • organooxygen compound