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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:47 UTC
Update Date2025-03-25 00:58:23 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230497
Frequency0.5
Structure
Chemical FormulaC7H13N3O3
Molecular Mass187.0957
SMILESCNC(=C[N+](=O)[O-])N1CCOCC1
InChI KeyJSIRRKBAXWSYHD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxazinanes
Subclass morpholines
Direct Parent morpholines
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • azacyclic compounds
  • c-nitro compounds
  • dialkyl ethers
  • dialkylamines
  • hydrocarbon derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
    • Substituents
  • ether
  • allyl-type 1,3-dipolar organic compound
  • dialkyl ether
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • c-nitro compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organic oxoazanium
  • secondary aliphatic amine
  • azacycle
  • organic 1,3-dipolar compound
  • secondary amine
  • oxacycle
  • morpholine
  • organic oxygen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • amine
  • organic hyponitrite