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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:57 UTC
Update Date2025-03-21 18:39:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00126928
Frequency20.1
Structure
Chemical FormulaC9H14O3
Molecular Mass170.0943
SMILESC=CC1(C)CCC(C(=O)CO)O1
InChI KeyOPWFLMNNXXOHGG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • dialkyl ethers
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
    • Substituents
  • alcohol
  • carbonyl group
  • ether
  • tetrahydrofuran
  • dialkyl ether
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound