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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:19 UTC
Update Date2025-03-25 00:52:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02197316
Frequency0.5
Structure
Chemical FormulaC8H13NO5
Molecular Mass203.0794
SMILESCCC(=O)NCC1OC(=O)C(O)C1O
InChI KeyFJYVBUIAGPTCPA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • monosaccharides
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary alcohols
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • monosaccharide
  • carboxylic acid derivative
  • saccharide
  • organic oxide
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • 1,2-diol
  • alcohol
  • tetrahydrofuran
  • carboxamide group
  • gamma butyrolactone
  • oxacycle
  • secondary carboxylic acid amide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound