Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:11:21 UTC
Update Date2025-03-25 00:57:53 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02227378
Frequency0.5
Structure
Chemical FormulaC13H16O
Molecular Mass188.1201
SMILESC=CCc1cc(C)c(C)c(C=O)c1C
InChI KeyDEUOANSALUKLBZ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzoyl derivatives
Direct Parent benzoyl derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • benzaldehydes
  • hydrocarbon derivatives
  • organic oxides
  • organooxygen compounds
  • Substituents
  • aromatic homomonocyclic compound
  • benzaldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • benzoyl
  • aldehyde
  • hydrocarbon derivative
  • organooxygen compound