Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:58:08 UTC
Update Date2025-03-25 00:52:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02196896
Frequency0.5
Structure
Chemical FormulaC15H16O
Molecular Mass212.1201
SMILESCCCC(=C=O)C=CC=Cc1ccccc1
InChI KeyAJODTKADPWFGJA-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass benzene and substituted derivatives
Direct Parent benzene and substituted derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • hydrocarbon derivatives
  • ketenes
  • organic oxides
  • ynolates
  • Substituents
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • organic oxide
  • organic oxygen compound
  • ynolate
  • hydrocarbon derivative
  • ketene
  • organooxygen compound