Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 06:34:42 UTC
Update Date2025-03-24 17:52:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00997718
Frequency1.4
Structure
Chemical FormulaC7H12O2
Molecular Mass128.0837
SMILESCC1OC2CCC1OC2
InChI KeyWBBNYLNQGAJADT-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classdioxanes
Subclass 1,4-dioxanes
Direct Parent 1,4-dioxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • para-dioxane
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound