ChemSpider 2D Image | (20S)-ginsenoside Rh2 | C36H62O8

(20S)-ginsenoside Rh2

  • Molecular FormulaC36H62O8
  • Average mass622.873 Da
  • Monoisotopic mass622.444458 Da
  • ChemSpider ID106568
  • defined stereocentres - 15 of 15 defined stereocentres


More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(20S)-ginsenoside Rh2
(3β,12β)-12,20-Dihydroxydammar-24-en-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,12β)-12,20-Dihydroxydammar-24-en-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de (3β,12β)-12,20-dihydroxydammar-24-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,12β)-12,20-dihydroxydammar-24-en-3-yl [ACD/Index Name]
(20S)-ginsenoside Rh2
(2R,3R,4S,5S,6R)-2-[[(3S,5R,8R,9R,10R,12R,13R,14R,17S)-12-hydroxy-17-[(2S)-2-hydroxy-6-methylhept-5-en-2-yl]-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
(2R,3R,4S,5S,6R)-2-{[(1R,2R,5S,7R,10R,11R,14S,15R,16R)-16-HYDROXY-14-[(2S)-2-HYDROXY-6-METHYLHEPT-5-EN-2-YL]-2,6,6,10,11-PENTAMETHYLTETRACYCLO[8.7.0.0ì,?.0––,–?]HEPTADECAN-5-YL]OXY}-6-(HYDROXYMETHYL)OXANE-3,4,5-TRIOL
(3b,12b)-12,20-Dihydroxydammar-24-en-3-yl b-D-glucopyranoside
(S)-(3b,12b)-12,20-dihydroxydammar-24-en-3-yl b-D-glucopyranoside
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  • Experimental Physico-chemical Properties
  • Miscellaneous
    • Safety:

      P261; P262 Biosynth Q-100827
    • Target Organs:

      EGFR inhibitor TargetMol T2959
    • Chemical Class:

      A ginsenoside found in <ital>Panax</ital> species that is dammarane which is substituted by hydroxy groups at the 3<stereo>beta</stereo>, 12<stereo>beta</stereo> and 20 <ital>pro</ital>-<stereo>S</ste reo> positions, in which the hydroxy group at position 3 has been converted to the corresponding <stereo>beta</stereo>-<stereo>D</stereo>-glucopyranoside, and in which a double bond has been introduce d at the 24-25 position. ChEBI CHEBI:77147
    • Bio Activity:

      EGFR TargetMol T2959
      Ginsenoside Rh2, an extract of red Panax ginseng, is a potent anti-inflammatory and anticancer drug. MedChem Express
      Ginsenoside Rh2, an extract of red Panax ginseng, is a potent anti-inflammatory and anticancer drug.; IC50 value:; Target:; In vitro: Ginsenoside Rh2 inhibited the growth of cultured human UL cells in vitro. MedChem Express HY-N0605
      Others MedChem Express HY-N0605
      Tyrosine Kinase/Adaptors TargetMol T2959

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 726.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.4 mmHg at 25°C
Enthalpy of Vaporization: 121.1±6.0 kJ/mol
Flash Point: 393.1±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 170.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 5.62
ACD/LogD (pH 5.5): 4.92
ACD/BCF (pH 5.5): 3243.93
ACD/KOC (pH 5.5): 11345.38
ACD/LogD (pH 7.4): 4.92
ACD/BCF (pH 7.4): 3243.91
ACD/KOC (pH 7.4): 11345.31
Polar Surface Area: 140 Å2
Polarizability: 67.7±0.5 10-24cm3
Surface Tension: 54.5±5.0 dyne/cm
Molar Volume: 519.1±5.0 cm3

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