Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:53:16 UTC
Update Date2025-03-25 00:51:17 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02185927
Frequency0.5
Structure
Chemical FormulaC18H20O4
Molecular Mass300.1362
SMILESO=C(Cc1ccccc1)OCC(O)COCc1ccccc1
InChI KeyWXOZCXWKYKJPTE-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classglycerolipids
Subclass other glycerolipids
Direct Parent other glycerolipids
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-alkyl,3-acylglycerols
  • benzylethers
  • carbonyl compounds
  • carboxylic acid esters
  • dialkyl ethers
  • glycerol ethers
  • hydrocarbon derivatives
  • monocarboxylic acids and derivatives
  • organic oxides
  • secondary alcohols
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • carbonyl group
  • ether
  • benzylether
  • 1-alkyl,3-acylglycerol
  • carboxylic acid derivative
  • dialkyl ether
  • aromatic homomonocyclic compound
  • organic oxide
  • monocarboxylic acid or derivatives
  • 1,3-dialkyl-sn-glycerol
  • organic oxygen compound
  • carboxylic acid ester
  • secondary alcohol
  • hydrocarbon derivative
  • benzenoid
  • glycerol ether
  • organooxygen compound