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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:20:11 UTC
Update Date2025-03-24 14:17:00 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00819027
Frequency1.8
Structure
Chemical FormulaC5H7NO4
Molecular Mass145.0375
SMILESO=C1CCC(C[N+](=O)[O-])O1
InChI KeyOVYCJZBCKJMAIK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • c-nitro compounds
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organic oxoanionic compounds
  • organic oxoazanium compounds
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • propargyl-type 1,3-dipolar organic compounds
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • allyl-type 1,3-dipolar organic compound
  • carboxylic acid derivative
  • organic nitro compound
  • propargyl-type 1,3-dipolar organic compound
  • organic oxide
  • c-nitro compound
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • organic oxoazanium
  • tetrahydrofuran
  • organic 1,3-dipolar compound
  • gamma butyrolactone
  • oxacycle
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound
  • organic hyponitrite