Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 11:43:27 UTC
Update Date2025-03-24 21:19:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID01738542
Frequency0.7
Structure
Chemical FormulaC8H16O
Molecular Mass128.1201
SMILESCC1CCOCC(C)C1
InChI KeyQRSBOQIWJCSJCA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound