Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 02:01:21 UTC
Update Date2025-03-21 20:10:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00346154
Frequency5.5
Structure
Chemical FormulaC4H6O4
Molecular Mass118.0266
SMILESOC1OC2OC2C1O
InChI KeyLMHIUWNRTBZHJU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,3-dioxanes
Direct Parent 1,3-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • epoxides
  • hemiacetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • tetrahydrofuran
  • oxirane
  • monosaccharide
  • aliphatic heteropolycyclic compound
  • oxacycle
  • saccharide
  • organic oxygen compound
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound