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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:55:10 UTC
Update Date2025-03-25 00:51:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02190296
Frequency0.5
Structure
Chemical FormulaC5H10NO2+
Molecular Mass116.0706
SMILESCC(=O)C(C)=[N+](C)O
InChI KeyMMLRDCBHIIHEIQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic nitrogen compounds
Classorganonitrogen compounds
Subclass imines
Direct Parent secondary ketimines
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • n-organohydroxylamines
  • organic cations
  • organic oxides
  • organopnictogen compounds
    • Substituents
  • aliphatic acyclic compound
  • carbonyl group
  • n-organohydroxylamine
  • ketone
  • secondary ketimine
  • organic oxide
  • organic oxygen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic cation
  • organooxygen compound