Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:13:35 UTC
Update Date2025-03-25 00:58:42 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02232329
Frequency0.5
Structure
Chemical FormulaC21H36O3
Molecular Mass336.2664
SMILESCCC(O)CCCCCCCCCCCCc1cc(O)cc(O)c1
InChI KeyHGGPDMQSXCNGLQ-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classfatty acyls
Subclass fatty alcohols
Direct Parent long-chain fatty alcohols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • resorcinols
  • secondary alcohols
  • Substituents
  • alcohol
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • aromatic homomonocyclic compound
  • long chain fatty alcohol
  • organic oxygen compound
  • secondary alcohol
  • phenol
  • hydrocarbon derivative
  • benzenoid
  • organooxygen compound