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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:09:24 UTC
Update Date2025-03-24 21:30:27 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01799631
Frequency0.7
Structure
Chemical FormulaC6H14N2O
Molecular Mass130.1106
SMILESNCCCNCCC=O
InChI KeyKNTQGCFBTUZEKC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent alpha-hydrogen aldehydes
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • dialkylamines
  • hydrocarbon derivatives
  • monoalkylamines
  • organic oxides
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • secondary aliphatic amine
  • secondary amine
  • organic oxide
  • alpha-hydrogen aldehyde
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • primary aliphatic amine
  • organic nitrogen compound
  • amine