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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 00:25:52 UTC
Update Date2025-03-21 18:39:09 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID00124339
Frequency20.7
Structure
Chemical FormulaC11H12O3
Molecular Mass192.0786
SMILESO=C(O)C(=Cc1ccccc1)CCO
InChI KeyQLXNTJSZOZSKFD-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassphenylpropanoids and polyketides
Classcinnamic acids and derivatives
Subclass cinnamic acids and derivatives
Direct Parent cinnamic acids and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • alcohols and polyols
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acids
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • carbonyl group
  • carboxylic acid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • cinnamic acid or derivatives
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound