Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:07:24 UTC
Update Date2025-03-24 14:11:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00788292
Frequency1.9
Structure
Chemical FormulaC5H8O3
Molecular Mass116.0473
SMILESOC1COC2COC12
InChI KeyVIWLVIDMRXIJNF-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
  • monosaccharides
  • oxacyclic compounds
  • oxetanes
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • ether
  • tetrahydrofuran
  • 1,4-dioxepane
  • monosaccharide
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • saccharide
  • organic oxygen compound
  • oxetane
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound