Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:07:43 UTC
Update Date2025-03-21 19:04:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00222154
Frequency9.8
Structure
Chemical FormulaC5H6O2
Molecular Mass98.0368
SMILESC1C2OC1C1OC21
InChI KeyFBUKQOGWFBOIKK-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
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • oxetanes
  • tetrahydrofurans
  • Substituents
  • ether
  • tetrahydrofuran
  • oxirane
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • para-dioxane
  • oxetane
  • hydrocarbon derivative
  • oxane
  • organooxygen compound