Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:49:40 UTC
Update Date2025-03-21 18:51:28 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00180526
Frequency12.8
Structure
Chemical FormulaC9H14O
Molecular Mass138.1045
SMILESCC1=CC2CC1C(C)(C)O2
InChI KeyKNBIAVMRWJHRPG-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classpyrans
Subclass pyrans
Direct Parent pyrans
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • aliphatic heteropolycyclic compound
  • oxacycle
  • ether
  • organic oxygen compound
  • tetrahydrofuran
  • pyran
  • hydrocarbon derivative
  • dialkyl ether
  • organooxygen compound