Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 15:21:57 UTC
Update Date2025-03-25 01:01:46 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02251577
Frequency0.5
Structure
Chemical FormulaC22H36O3
Molecular Mass348.2664
SMILESO=CCCCCCCCCCCCCCCCc1cc(O)cc(O)c1
InChI KeyHJPTXQAVHBJSAB-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenols
Subclass benzenediols
Direct Parent resorcinols
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • alpha-hydrogen aldehydes
  • benzene and substituted derivatives
  • hydrocarbon derivatives
  • organic oxides
  • Substituents
  • monocyclic benzene moiety
  • carbonyl group
  • 1-hydroxy-2-unsubstituted benzenoid
  • aldehyde
  • 1-hydroxy-4-unsubstituted benzenoid
  • resorcinol
  • aromatic homomonocyclic compound
  • organic oxide
  • organic oxygen compound
  • alpha-hydrogen aldehyde
  • hydrocarbon derivative
  • organooxygen compound