Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 01:36:30 UTC
Update Date2025-03-21 19:59:02 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00288716
Frequency7.0
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC12CCCC(CC1)CO2
InChI KeyIMXMMMDLHKAWBC-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
  • oxanes
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound