Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:06:08 UTC
Update Date2025-03-24 21:01:54 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01648567
Frequency0.8
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC12C=CC(O)CC(C1)O2
InChI KeyPMYZFPLRPWMFCC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxetanes
Subclass oxetanes
Direct Parent oxetanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • oxetane
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound