Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:19:02 UTC
Update Date2025-03-25 01:00:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02244863
Frequency0.5
Structure
Chemical FormulaC16H31N7OS
Molecular Mass369.2311
SMILESCN(C)Cc1ccc(CSCCNC(=N)NC(=N)NCCCCN)o1
InChI KeyVZRTXDGRKVVQNQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass guanidines
Direct Parent biguanides
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • aralkylamines
  • carboximidamides
  • dialkylthioethers
  • furans
  • heteroaromatic compounds
  • hydrocarbon derivatives
  • imines
  • monoalkylamines
  • organooxygen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • sulfenyl compounds
  • trialkylamines
  • Substituents
  • furan
  • aromatic heteromonocyclic compound
  • imine
  • organosulfur compound
  • aralkylamine
  • organopnictogen compound
  • tertiary amine
  • organoheterocyclic compound
  • sulfenyl compound
  • dialkylthioether
  • heteroaromatic compound
  • tertiary aliphatic amine
  • carboximidamide
  • oxacycle
  • organic oxygen compound
  • thioether
  • hydrocarbon derivative
  • primary aliphatic amine
  • biguanide
  • amine
  • organooxygen compound