Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:39:32 UTC
Update Date2025-03-24 14:31:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00865573
Frequency1.7
Structure
Chemical FormulaC5H8O4
Molecular Mass132.0423
SMILESOC1OCC2OC1C2O
InChI KeyJJPHSVGPUSYORU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • oxetanes
  • secondary alcohols
  • Substituents
  • alcohol
  • ether
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • para-dioxane
  • oxetane
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound