Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:20:37 UTC
Update Date2025-03-21 18:36:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00111862
Frequency23.8
Structure
Chemical FormulaC13H24O
Molecular Mass196.1827
SMILESCC1(C)OC(C)(C)C2(C)CCC1CC2
InChI KeyNEJPLWBSBBPDGN-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound