Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:23:11 UTC
Update Date2025-03-21 18:37:56 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00118082
Frequency22.1
Structure
Chemical FormulaC17H20O
Molecular Mass240.1514
SMILESCC1=CC(=O)CC(C)(C)C1C=Cc1ccccc1
InChI KeyIBNNDXDFDAUQHC-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassorganic oxygen compounds
Classorganooxygen compounds
Subclass carbonyl compounds
Direct Parent cyclohexenones
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • aromatic homomonocyclic compound
  • cyclohexenone
  • monocyclic benzene moiety
  • organic oxide
  • hydrocarbon derivative
  • benzenoid