Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:37:45 UTC
Update Date2025-03-21 17:57:48 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00010245
Frequency462.7
Structure
Chemical FormulaC9H16O
Molecular Mass140.1201
SMILESCC12CCC(C1)C(C)(C)O2
InChI KeyBSXAEDOAETUWQS-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • hydrocarbon derivative
  • oxane
  • dialkyl ether
  • organooxygen compound