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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 14:49:23 UTC
Update Date2025-03-25 00:49:51 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02177113
Frequency0.5
Structure
Chemical FormulaC29H41NO13
Molecular Mass611.2578
SMILESCOc1ccc2c3c1OC1C(OC4OC(COC5OC(CO)C(O)C(O)C5O)C(O)C(O)C4O)CC4C(C2)N(C)CCC341
InChI KeyALRLIDJRLVNHDH-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclassbenzenoids
Classtetralins
Subclass tetralins
Direct Parent tetralins
Geometric Descriptor aromatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • alkyl aryl ethers
  • anisoles
  • azacyclic compounds
  • coumarans
  • hydrocarbon derivatives
  • monosaccharides
  • organopnictogen compounds
  • oxacyclic compounds
  • oxanes
  • piperidines
  • primary alcohols
  • secondary alcohols
  • trialkylamines
    • Substituents
  • tetralin
  • phenol ether
  • ether
  • monosaccharide
  • alkyl aryl ether
  • saccharide
  • acetal
  • aromatic heteropolycyclic compound
  • organonitrogen compound
  • organopnictogen compound
  • oxane
  • primary alcohol
  • piperidine
  • tertiary amine
  • organoheterocyclic compound
  • coumaran
  • alcohol
  • azacycle
  • tertiary aliphatic amine
  • oxacycle
  • organic oxygen compound
  • anisole
  • secondary alcohol
  • hydrocarbon derivative
  • organic nitrogen compound
  • amine
  • organooxygen compound