Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:36:16 UTC
Update Date2025-03-24 13:59:07 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00713521
Frequency2.2
Structure
Chemical FormulaC8H12O2
Molecular Mass140.0837
SMILESCC1(O)CC2CC1C1OC21
InChI KeyAVSWMRXACKNKOR-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classprenol lipids
Subclass monoterpenoids
Direct Parent monoterpenoids
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • cyclic alcohols and derivatives
  • dialkyl ethers
  • epoxides
  • hydrocarbon derivatives
  • oxacyclic compounds
  • oxanes
  • oxepanes
  • tertiary alcohols
  • Substituents
  • alcohol
  • monoterpenoid
  • ether
  • oxirane
  • norbornane monoterpenoid
  • cyclic alcohol
  • dialkyl ether
  • aliphatic heteropolycyclic compound
  • oxepane
  • oxacycle
  • tertiary alcohol
  • organic oxygen compound
  • hydrocarbon derivative
  • oxane
  • organoheterocyclic compound
  • organooxygen compound