Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:01:49 UTC
Update Date2025-03-21 20:11:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00347243
Frequency5.5
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESOC1CCC2OC2C1
InChI KeyOULAQVCZRNCPNC-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
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • oxirane
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • organic oxygen compound
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound