Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 12:33:20 UTC
Update Date2025-03-24 21:41:12 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01856630
Frequency0.7
Structure
Chemical FormulaC7H10O3
Molecular Mass142.063
SMILESOC1CC2CC(O2)C2OC12
InChI KeyASAZMVUIWANRIJ-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
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxetanes
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • oxirane
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • oxetane
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound