Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:50:41 UTC
Update Date2025-03-21 18:51:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00182891
Frequency12.6
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC1(C)CCCC2(C)OC12
InChI KeyAHIVAUWCTZBWNE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxepanes
Subclass oxepanes
Direct Parent oxepanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • ether
  • organic oxygen compound
  • oxirane
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound