Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:48 UTC
Update Date2025-03-25 00:58:47 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02232819
Frequency0.5
Structure
Chemical FormulaC10H14O5
Molecular Mass214.0841
SMILESCC=CC(=O)OC1C=CC(O)C(O)C1O
InChI KeyFZJFAMNIYSEXRJ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty acid esters
Direct Parent fatty acid esters
Geometric Descriptor aliphatic homomonocyclic compounds
Alternative Parents
  • carbonyl compounds
  • cyclitols and derivatives
  • enoate esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • enoate ester
  • alcohol
  • carbonyl group
  • cyclitol or derivatives
  • carboxylic acid derivative
  • alpha,beta-unsaturated carboxylic ester
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • aliphatic homomonocyclic compound
  • hydrocarbon derivative
  • organooxygen compound