Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:28:18 UTC
Update Date2025-03-24 17:49:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00982518
Frequency1.4
Structure
Chemical FormulaC5H8O2
Molecular Mass100.0524
SMILESC1OCC2OCC12
InChI KeyKAIDVXINASNRNL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxepanes
Subclass 1,4-dioxepanes
Direct Parent 1,4-dioxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • ether
  • tetrahydrofuran
  • 1,4-dioxepane
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • oxetane
  • hydrocarbon derivative
  • organooxygen compound