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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 10:03:24 UTC
Update Date2025-03-24 20:35:16 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01497673
Frequency0.9
Structure
Chemical FormulaC4H10N2O3
Molecular Mass134.0691
SMILESCN(C)CCOON=O
InChI KeyQSTVDYRZZNEJOO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganic oxoanionic compounds
Subclass organic peroxynitrites
Direct Parent organic peroxynitrites
Geometric Descriptor aliphatic acyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • organic o-nitroso compounds
  • organic nitrites
  • organic oxides
  • organooxygen compounds
  • organopnictogen compounds
  • trialkylamines
    • Substituents
  • aliphatic acyclic compound
  • organic nitroso compound
  • tertiary aliphatic amine
  • organic nitrite
  • organic peroxynitrite
  • organic oxide
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • tertiary amine
  • organooxygen compound
  • organic o-nitroso compound