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Record Information
HMDB StatusNot Available
Creation Date2024-02-21 16:50:27 UTC
Update Date2025-03-25 01:35:49 UTC
HMDB IDNot Available
Metabolite Identification
DeepMet IDDMID02456493
Frequency0.5
Structure
Chemical FormulaC45H76O16
Molecular Mass872.5133
SMILESCC(C)CCCC(C)C1CCC2C3CC=C4CC(OC5OC(COC6OC(CO)C(O)C(O)C6O)C(OC6OC(CO)C(O)C(O)C6O)C(O)C5O)CCC4(C)C3CCC12C
InChI KeySOUJLPUWYXUKEF-UHFFFAOYSA-N
Chemical Taxonomy
Kingdomorganic compounds
Superclasslipids and lipid-like molecules
Classsteroids and steroid derivatives
Subclass steroidal glycosides
Direct Parent steroidal glycosides
Geometric Descriptor aliphatic heteropolycyclic compounds
Alternative Parents
  • acetals
  • cholesterols and derivatives
  • delta-5-steroids
  • diterpene glycosides
  • diterpenoids
  • hydrocarbon derivatives
  • monosaccharides
  • oxacyclic compounds
  • oxanes
  • primary alcohols
  • secondary alcohols
    • Substituents
  • delta-5-steroid
  • alcohol
  • abietane diterpenoid
  • steroidal glycoside
  • monosaccharide
  • terpene glycoside
  • cholesterol
  • diterpene glycoside
  • aliphatic heteropolycyclic compound
  • oxacycle
  • saccharide
  • organic oxygen compound
  • acetal
  • secondary alcohol
  • hydrocarbon derivative
  • cholestane-skeleton
  • oxane
  • diterpenoid
  • primary alcohol
  • organoheterocyclic compound
  • organooxygen compound