Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:45:20 UTC
Update Date2025-03-24 17:57:20 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01022935
Frequency1.4
Structure
Chemical FormulaC6H10O2
Molecular Mass114.0681
SMILESCC1(C)CC2OC2O1
InChI KeyGJPBGHZROIYPBR-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
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • tetrahydrofuran
  • oxirane
  • hydrocarbon derivative
  • meta-dioxane
  • organooxygen compound