ChemSpider 2D Image | (3beta,6alpha,12beta)-3,12,20-Trihydroxydammar-24-en-6-yl hexopyranoside | C36H62O9

(3β,6α,12β)-3,12,20-Trihydroxydammar-24-en-6-yl hexopyranoside

  • Molecular FormulaC36H62O9
  • Average mass638.872 Da
  • Monoisotopic mass638.439392 Da
  • ChemSpider ID23089635

  • defined stereocentres - 11 of 16 defined stereocentres

More details:

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

(3β,6α,12β)-3,12,20-Trihydroxydammar-24-en-6-yl hexopyranoside [ACD/IUPAC Name]
(3β,6α,12β)-3,12,20-Trihydroxydammar-24-en-6-ylhexopyranosid [German] [ACD/IUPAC Name]
Hexopyranoside de (3β,6α,12β)-3,12,20-trihydroxydammar-24-én-6-yle [French] [ACD/IUPAC Name]
Hexopyranoside, (3β,6α,12β)-3,12,20-trihydroxydammar-24-en-6-yl [ACD/Index Name]
63223-86-9 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 755.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 125.5±6.0 kJ/mol
Flash Point: 410.5±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: 3.74
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 213.94
ACD/KOC (pH 5.5): 1620.41
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 213.93
ACD/KOC (pH 7.4): 1620.40
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

Click to predict properties on the Chemicalize site


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