Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:37 UTC
Update Date2025-03-25 00:57:59 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227944
Frequency0.5
Structure
Chemical FormulaC11H18O2
Molecular Mass182.1307
SMILESC=CC(=O)C1(C)CCCC(C)(C)O1
InChI KeyNIFIMQWEEMOPMV-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganoheterocyclic compounds
Classoxanes
Subclass oxanes
Direct Parent oxanes
Geometric Descriptor aliphatic heteromonocyclic compounds
Alternative Parents
  • alpha,beta-unsaturated ketones
  • dialkyl ethers
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • carbonyl group
  • ether
  • alpha,beta-unsaturated ketone
  • dialkyl ether
  • ketone
  • oxacycle
  • organic oxide
  • organic oxygen compound
  • aliphatic heteromonocyclic compound
  • hydrocarbon derivative
  • oxane
  • organooxygen compound