Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:51 UTC
Update Date2025-03-25 00:51:30 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02187318
Frequency0.5
Structure
Chemical FormulaC20H22O2
Molecular Mass294.162
SMILESCC(=O)c1cc2c(cc1C)C(C)(C)OC2(C)c1ccccc1
InChI KeyOWFQFAVFHGVOFD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass acetophenones
Direct Parent acetophenones
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • aryl alkyl ketones
  • dialkyl ethers
  • hydrocarbon derivatives
  • isocoumarans
  • organic oxides
  • oxacyclic compounds
  • Substituents
  • ether
  • aryl alkyl ketone
  • dialkyl ether
  • ketone
  • oxacycle
  • organic oxide
  • isocoumaran
  • organic oxygen compound
  • aromatic heteropolycyclic compound
  • acetophenone
  • hydrocarbon derivative
  • organoheterocyclic compound
  • organooxygen compound
  • aryl ketone