ChemSpider 2D Image | dulcoside B | C38H60O17

dulcoside B

  • Molecular FormulaC38H60O17
  • Average mass788.873 Da
  • Monoisotopic mass788.383057 Da
  • ChemSpider ID24606166

  • defined stereocentres - 21 of 21 defined stereocentres

More details:

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

(5β,8α,9β,10α,13α)-13-{[6-Deoxy-α-L-mannopyranosyl-(1->;2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl]oxy}kaur-16-en-18-oic acid [ACD/IUPAC Name]
(5β,8α,9β,10α,13α)-13-{[6-Desoxy-α-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl]oxy}kaur-16-en-18-säure [German] [ACD/IUPAC Name]
Acide (5β,8α,9β,10α,13α)-13-{[6-désoxy-α-L-mannopyranosyl-(1->2)-[β-D-glucopyranosyl-(1->3)]-β-D-glucopyranosyl]oxy}kaur-16-én-18-oïque [French] [ACD/IUPAC Name]
dulcoside B
(4R)-13-[(2-O-α-L-Rhamnopyranosyl-3-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]kaura-16-ene-18-oic acid

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

Density: 1.5±0.1 g/cm3
Boiling Point: 964.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 159.3±6.0 kJ/mol
Flash Point: 291.7±27.8 °C
Index of Refraction: 1.635
Molar Refractivity: 188.8±0.4 cm3
#H bond acceptors: 17
#H bond donors: 10
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 2.31
ACD/KOC (pH 5.5): 34.63
ACD/LogD (pH 7.4): -0.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 275 Å2
Polarizability: 74.9±0.5 10-24cm3
Surface Tension: 80.3±5.0 dyne/cm
Molar Volume: 527.6±5.0 cm3

Click to predict properties on the Chemicalize site


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