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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:28:07 UTC
Update Date2025-03-21 18:40:21 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00129730
Frequency19.6
Structure
Chemical FormulaC10H16O3
Molecular Mass184.1099
SMILESC=CC1(C)CCC(C(C)(O)C=O)O1
InChI KeyPXPNIOAYOYHOCP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha-hydroxyaldehydes
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • carbonyl group
  • ether
  • tetrahydrofuran
  • aldehyde
  • dialkyl ether
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • alpha-hydroxyaldehyde
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound