Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:05:04 UTC
Update Date2025-03-25 00:55:35 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02213099
Frequency0.5
Structure
Chemical FormulaC15H22O4
Molecular Mass266.1518
SMILESCCCCCCC(=O)OCCc1ccc(O)c(O)c1
InChI KeyVATDSKBCLFZVAU-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass tyrosols and derivatives
Direct Parent tyrosols and derivatives
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • carbonyl compounds
  • carboxylic acid esters
  • fatty acid esters
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • Substituents
  • fatty acyl
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • carboxylic acid derivative
  • aromatic homomonocyclic compound
  • fatty acid ester
  • organic oxide
  • monocarboxylic acid or derivatives
  • organic oxygen compound
  • carboxylic acid ester
  • hydrocarbon derivative
  • tyrosol derivative
  • organooxygen compound