Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:14:58 UTC
Update Date2025-03-25 00:59:10 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02235547
Frequency0.5
Structure
Chemical FormulaC11H12O2
Molecular Mass176.0837
SMILESCOc1ccc(CC(C)=C=O)cc1
InChI KeySLKZTVAZNZFKHK-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alkyl aryl ethers
  • anisoles
  • hydrocarbon derivatives
  • ketenes
  • methoxybenzenes
  • organic oxides
  • phenoxy compounds
  • ynolates
  • Substituents
  • phenol ether
  • ether
  • alkyl aryl ether
  • methoxybenzene
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • ynolate
  • anisole
  • hydrocarbon derivative
  • phenoxy compound
  • ketene
  • organooxygen compound