ChemSpider 2D Image | (3alpha,5beta,6beta,8alpha,9beta,10alpha,12alpha,13alpha,14beta,17alpha)-3,12-Dihydroxydammara-20,24-dien-6-yl 2-O-(6-deoxy-alpha-D-mannopyranosyl)-beta-L-glucopyranoside | C42H70O12

(3α,5β,6β,8α,9β,10α,12α,13α,14β,17α)-3,12-Dihydroxydammara-20,24-dien-6-yl 2-O-(6-deoxy-α-D-mannopyranosyl)-β-L-glucopyranoside

  • Molecular FormulaC42H70O12
  • Average mass766.998 Da
  • Monoisotopic mass766.486755 Da
  • ChemSpider ID68905879

  • defined stereocentres - 20 of 20 defined stereocentres

More details:

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

(3α,5β,6β,8α,9β,10α,12α,13α,14β,17α)-3,12-Dihydroxydammara-20,24-dien-6-yl 2-O-(6-deoxy-α-D-mannopyranosyl)-β-L-glucopyranoside [ACD/IUPAC Name]
(3α,5β,6β,8α,9β,10α,12α,13α,14β,17α)-3,12-Dihydroxydammara-20,24-dien-6-yl-2-O-(6-desoxy-α-D-mannopyranosyl)-β-L-glucopyranosid [German] [ACD/IUPAC Name]
2-O-(6-Désoxy-α-D-mannopyranosyl)-β-L-glucopyranoside de (3α,5β,6β,8α,9β,10α,12α,13α,14β,17α)-3,12-dihydroxydammara-20,24-dién-6-yle [French] [ACD/IUPAC Name]
β-L-Glucopyranoside, (3α,5β,6β,8α,9β,10α,12α,13α,14β,17α)-3,12-dihydroxydammara-20,24-dien-6-yl 2-O-(6-deoxy-α-D-mannopyranosyl)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 850.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 140.5±6.0 kJ/mol
Flash Point: 468.2±34.3 °C
Index of Refraction: 1.589
Molar Refractivity: 202.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 4
ACD/LogP: 8.20
ACD/LogD (pH 5.5): 5.84
ACD/BCF (pH 5.5): 16104.63
ACD/KOC (pH 5.5): 35720.93
ACD/LogD (pH 7.4): 5.84
ACD/BCF (pH 7.4): 16104.45
ACD/KOC (pH 7.4): 35720.54
Polar Surface Area: 199 Å2
Polarizability: 80.2±0.5 10-24cm3
Surface Tension: 60.1±5.0 dyne/cm
Molar Volume: 600.9±5.0 cm3

Click to predict properties on the Chemicalize site


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