Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 04:04:56 UTC
Update Date2025-03-21 23:07:03 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00639001
Frequency2.5
Structure
Chemical FormulaC8H14O2
Molecular Mass142.0994
SMILESCC12CCC(C1)C(C)(O)O2
InChI KeyURSJSAVGFMCUGL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • hemiacetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • organic oxygen compound
  • tetrahydrofuran
  • hemiacetal
  • hydrocarbon derivative
  • oxane
  • organooxygen compound