ChemSpider 2D Image | (1beta,2alpha,3beta,20R)-1,2,20-Trihydroxydammar-24-en-3-yl beta-D-glucopyranoside | C36H62O9

(1β,2α,3β,20R)-1,2,20-Trihydroxydammar-24-en-3-yl β-D-glucopyranoside

  • Molecular FormulaC36H62O9
  • Average mass638.872 Da
  • Monoisotopic mass638.439392 Da
  • ChemSpider ID8993188

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(1β,2α,3β,20R)-1,2,20-Trihydroxydammar-24-en-3-yl β-D-glucopyranoside [ACD/IUPAC Name]
(1β,2α,3β,20R)-1,2,20-Trihydroxydammar-24-en-3-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
β-D-Glucopyranoside de (1β,2α,3β,20R)-1,2,20-trihydroxydammar-24-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (1β,2α,3β,20R)-1,2,20-trihydroxydammar-24-en-3-yl [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 741.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.6 mmHg at 25°C
Enthalpy of Vaporization: 123.4±6.0 kJ/mol
Flash Point: 402.0±32.9 °C
Index of Refraction: 1.581
Molar Refractivity: 172.2±0.4 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.92
ACD/LogD (pH 5.5): 4.29
ACD/BCF (pH 5.5): 1077.52
ACD/KOC (pH 5.5): 5154.76
ACD/LogD (pH 7.4): 4.29
ACD/BCF (pH 7.4): 1077.51
ACD/KOC (pH 7.4): 5154.73
Polar Surface Area: 160 Å2
Polarizability: 68.3±0.5 10-24cm3
Surface Tension: 57.8±5.0 dyne/cm
Molar Volume: 516.9±5.0 cm3

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