Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:55:31 UTC
Update Date2025-03-21 18:53:33 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00193872
Frequency11.7
Structure
Chemical FormulaC5H8O4
Molecular Mass132.0423
SMILESOC1OC2CC(O2)C1O
InChI KeyUYWGGVCOVJQEPM-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
  • acetals
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • oxetanes
  • secondary alcohols
  • Substituents
  • alcohol
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • acetal
  • oxetane
  • secondary alcohol
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • meta-dioxane
  • organooxygen compound