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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 13:49:46 UTC
Update Date2025-03-25 00:28:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02037915
Frequency0.6
Structure
Chemical FormulaC5H7NO4
Molecular Mass145.0375
SMILESO=NOCC1CCC(=O)O1
InChI KeyPDLHZAJAKIMPIL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alkyl nitrites
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • nitrite esters
  • organic o-nitroso compounds
  • organic nitrogen compounds
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • organic nitroso compound
  • tetrahydrofuran
  • carboxylic acid derivative
  • organic nitrite
  • gamma butyrolactone
  • alkyl nitrite
  • oxacycle
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • nitrite ester
  • organic nitrogen compound
  • organooxygen compound
  • organic o-nitroso compound