Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:00:01 UTC
Update Date2025-03-25 00:53:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02201319
Frequency0.5
Structure
Chemical FormulaC13H22O3
Molecular Mass226.1569
SMILESC=CC1(C)CCC(C2(O)CCC(C)CO2)O1
InChI KeyJKTQENCNEIDKFG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hemiacetals
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • oxacycle
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • aliphatic heteromonocyclic compound
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound