Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:56 UTC
Update Date2025-03-25 00:51:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189767
Frequency0.5
Structure
Chemical FormulaC12H16O
Molecular Mass176.1201
SMILESC=CCOc1ccccc1C(C)C
InChI KeyZRTGNSUOVSGTFW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass cumenes
Direct Parent cumenes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • hydrocarbon derivatives
  • phenol ethers
  • phenoxy compounds
  • phenylpropanes
  • Substituents
  • phenol ether
  • ether
  • alkyl aryl ether
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • cumene
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound