Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:09 UTC
Update Date2025-03-25 00:58:31 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02231335
Frequency0.5
Structure
Chemical FormulaC12H16O2
Molecular Mass192.115
SMILESCC1CCCC(Oc2ccccc2)O1
InChI KeyYRJSBVIBZBZGQO-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic heteromonocyclic compounds
Alternative Parents
  • acetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • oxacyclic compounds
  • oxanes
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • aromatic heteromonocyclic compound
  • oxacycle
  • organic oxygen compound
  • acetal
  • hydrocarbon derivative
  • phenoxy compound
  • oxane
  • organoheterocyclic compound
  • organooxygen compound