Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:26:54 UTC
Update Date2025-03-21 18:39:41 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00126797
Frequency20.2
Structure
Chemical FormulaC12H18O2
Molecular Mass194.1307
SMILESCC1CCC2(C=CC(=O)CC2(C)C)O1
InChI KeyCDSDAQNEGRVTRX-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • dialkyl ethers
  • hydrocarbon derivatives
  • organic oxides
  • oxacyclic compounds
  • tetrahydrofurans
  • Substituents
  • cyclohexenone
  • ether
  • tetrahydrofuran
  • dialkyl ether
  • oxacycle
  • organic oxide
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • organoheterocyclic compound