Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:08:46 UTC
Update Date2025-03-21 22:10:45 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00506122
Frequency3.4
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESOC1CC2COC(C1)C2
InChI KeyQTZFQUZYQLEDMK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • tetrahydrofuran
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound