Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:24:23 UTC
Update Date2025-03-21 23:16:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00684967
Frequency2.3
Structure
Chemical FormulaC4H6O2
Molecular Mass86.0368
SMILESC1CC2OC2O1
InChI KeyGOKABALRNHVSMJ-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