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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:27 UTC
Update Date2025-03-25 00:51:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02186357
Frequency0.5
Structure
Chemical FormulaC8H17N3O
Molecular Mass171.1372
SMILESNCCCCCCNC(N)=C=O
InChI KeyGXXYMWKVSYFURB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass amines
Direct Parent dialkylamines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
  • ynolates
    • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • organic oxide
  • organic oxygen compound
  • ynolate
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organooxygen compound