Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:54:42 UTC
Update Date2025-03-25 00:51:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02189252
Frequency0.5
Structure
Chemical FormulaC15H22O
Molecular Mass218.1671
SMILESCC(C)CC(=O)C(C)(C)Cc1ccccc1
InChI KeyGRVGIATUJCPOMP-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound