Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:12:46 UTC
Update Date2025-03-25 00:58:24 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02230464
Frequency0.5
Structure
Chemical FormulaC11H14O
Molecular Mass162.1045
SMILESCCc1cc(C=O)c(C)cc1C
InChI KeyDZMQORPFNCNRPK-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
  • m-xylenes
  • Substituents
  • m-xylene
  • benzoyl
  • aldehyde
  • aromatic homomonocyclic compound
  • xylene
  • benzaldehyde
  • organic oxide
  • aryl-aldehyde
  • organic oxygen compound
  • hydrocarbon derivative
  • organooxygen compound