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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:45:44 UTC
Update Date2025-03-25 00:48:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02168700
Frequency0.5
Structure
Chemical FormulaC11H19NO3
Molecular Mass213.1365
SMILESCC(C)C(=O)NC1CC(=O)OC1C(C)C
InChI KeyJTFORBIRKMDIIM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • carboxylic acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • organonitrogen compounds
  • organopnictogen compounds
  • oxacyclic compounds
  • secondary carboxylic acid amides
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • tetrahydrofuran
  • carboxamide group
  • carboxylic acid derivative
  • gamma butyrolactone
  • oxacycle
  • secondary carboxylic acid amide
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • hydrocarbon derivative
  • organic nitrogen compound
  • organooxygen compound