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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:06:09 UTC
Update Date2025-03-25 00:56:01 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02215548
Frequency0.5
Structure
Chemical FormulaC7H10O4
Molecular Mass158.0579
SMILESCC1OC(=O)C(C(=O)O)C1C
InChI KeyRWDRYZXHQHEJIV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classlactones
Subclass gamma butyrolactones
Direct Parent gamma butyrolactones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,3-dicarbonyl compounds
  • carboxylic acid esters
  • carboxylic acids
  • dicarboxylic acids and derivatives
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
    • Substituents
  • carbonyl group
  • carboxylic acid
  • tetrahydrofuran
  • carboxylic acid derivative
  • gamma butyrolactone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • carboxylic acid ester
  • aliphatic heteromonocyclic compound
  • dicarboxylic acid or derivatives
  • hydrocarbon derivative
  • 1,3-dicarbonyl compound
  • organooxygen compound