Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-20 23:36:03 UTC
Update Date2025-03-21 17:57:11 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00006238
Frequency832.5
Structure
Chemical FormulaC9H10O2
Molecular Mass150.0681
SMILESCC(=O)C(O)c1ccccc1
InChI KeyZBFFNPODXBJBPW-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classbenzene and substituted derivatives
Subclass phenylpropanes
Direct Parent phenylpropanes
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • acyloins
  • alpha-hydroxy ketones
  • aromatic alcohols
  • hydrocarbon derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • aromatic alcohol
  • alcohol
  • carbonyl group
  • alpha-hydroxy ketone
  • ketone
  • phenylpropane
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • acyloin
  • secondary alcohol
  • hydrocarbon derivative
  • organooxygen compound