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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:04:11 UTC
Update Date2025-03-21 18:28:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00072170
Frequency41.4
Structure
Chemical FormulaC9H16O3
Molecular Mass172.1099
SMILESC=CC1(O)CCC(C(C)(C)O)O1
InChI KeyQCCBJIWTAGYUOZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
    • Substituents
  • alcohol
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • tetrahydrofuran
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • organooxygen compound