Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:43:50 UTC
Update Date2025-03-25 00:47:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02164316
Frequency0.5
Structure
Chemical FormulaC9H16O3
Molecular Mass172.1099
SMILESCC(O)C(O)C1C=CC(C)(C)O1
InChI KeyNGGYCNZEBPGPQC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdihydrofurans
Subclass dihydrofurans
Direct Parent dihydrofurans
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • 1,2-diols
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • dialkyl ether
  • oxacycle
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound
  • 1,2-diol
  • dihydrofuran