Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:38:10 UTC
Update Date2025-03-21 17:57:57 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00011228
Frequency413.4
Structure
Chemical FormulaC9H16O3
Molecular Mass172.1099
SMILESCC1(C=O)CCC(C(C)(C)O)O1
InChI KeyBMIZWSAOWJBOCX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classtetrahydrofurans
Subclass tetrahydrofurans
Direct Parent tetrahydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • aldehydes
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • carbonyl group
  • ether
  • tetrahydrofuran
  • aldehyde
  • dialkyl ether
  • oxacycle
  • tertiary alcohol
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound