Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:02:22 UTC
Update Date2025-03-21 20:11:26 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00348538
Frequency5.5
Structure
Chemical FormulaC8H10O2
Molecular Mass138.0681
SMILESC=CC1(O)C2CC1C1OC12
InChI KeyZTZBQBDHOQLJEB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tertiary alcohols
  • Substituents
  • alcohol
  • ether
  • oxirane
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • cyclobutanol
  • hydrocarbon derivative
  • oxane
  • organooxygen compound