Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 08:36:15 UTC
Update Date2025-03-25 00:21:05 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01290724
Frequency1.0
Structure
Chemical FormulaC6H10O3
Molecular Mass130.063
SMILESOC1CC2OCCC1O2
InChI KeyQPKXOVTWRIEKHY-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • 1,3-dioxanes
  • acetals
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • secondary alcohols
  • tetrahydrofurans
  • Substituents
  • alcohol
  • tetrahydrofuran
  • monosaccharide
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound