Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 05:04:41 UTC
Update Date2025-03-24 14:10:55 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00781754
Frequency1.9
Structure
Chemical FormulaC10H8O
Molecular Mass144.0575
SMILESCC(=O)C#Cc1ccccc1
InChI KeyUPEUQDJSUFHFQP-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
  • alpha,beta-unsaturated ketones
  • hydrocarbon derivatives
  • ketones
  • organic oxides
  • Substituents
  • ketone
  • aromatic homomonocyclic compound
  • monocyclic benzene moiety
  • carbonyl group
  • organic oxide
  • organic oxygen compound
  • hydrocarbon derivative
  • alpha,beta-unsaturated ketone
  • organooxygen compound