Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 03:47:40 UTC
Update Date2025-03-21 22:56:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00598801
Frequency2.7
Structure
Chemical FormulaC6H12O2
Molecular Mass116.0837
SMILESOC1CCCOCC1
InChI KeyXSVKOKYISGWZPQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • secondary alcohols
  • Substituents
  • alcohol
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • secondary alcohol
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound