Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 09:13:43 UTC
Update Date2025-03-24 20:13:50 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01380359
Frequency0.9
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC12C=CC(O)C(CC1)O2
InChI KeyHRTNVIVURBUNGM-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • tetrahydrofuran
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • pyran
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound