Hmdb loader
Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:46:28 UTC
Update Date2025-03-25 00:48:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02170342
Frequency0.5
Structure
Chemical FormulaC31H56O3
Molecular Mass476.4229
SMILESCCCCCCCCCCCCCCCCCCCCCCCc1cc(O)cc(OCOC)c1
InChI KeyHDRUTCROKZSJGL-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classphenol ethers
Subclass phenol ethers
Direct Parent phenol ethers
Geometric Descriptor aromatic homomonocyclic compounds
Alternative Parents
  • 1-hydroxy-2-unsubstituted benzenoids
  • 1-hydroxy-4-unsubstituted benzenoids
  • acetals
  • hydrocarbon derivatives
  • organooxygen compounds
  • phenoxy compounds
  • Substituents
  • phenol ether
  • monocyclic benzene moiety
  • 1-hydroxy-2-unsubstituted benzenoid
  • 1-hydroxy-4-unsubstituted benzenoid
  • aromatic homomonocyclic compound
  • organic oxygen compound
  • acetal
  • phenol
  • hydrocarbon derivative
  • phenoxy compound
  • organooxygen compound