ChemSpider 2D Image | (3beta,7alpha,25R)-7-Hydroxyspirost-5-en-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside | C39H62O13

(3β,7α,25R)-7-Hydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC39H62O13
  • Average mass738.902 Da
  • Monoisotopic mass738.419067 Da
  • ChemSpider ID9472139

  • defined stereocentres - 22 of 22 defined stereocentres

More details:

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

(3β,7α,25R)-7-Hydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,7α,25R)-7-Hydroxyspirost-5-en-3-yl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de (3β,7α,25R)-7-hydroxyspirost-5-én-3-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (3β,7α,25R)-7-hydroxyspirost-5-en-3-yl 2-O-(6-deoxy-α-L-mannopyranosyl)- [ACD/Index Name]
SANSEVIERIN A

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

Density: 1.4±0.1 g/cm3
Boiling Point: 870.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 143.8±6.0 kJ/mol
Flash Point: 480.4±34.3 °C
Index of Refraction: 1.614
Molar Refractivity: 186.8±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 3
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 3.88
ACD/BCF (pH 5.5): 519.99
ACD/KOC (pH 5.5): 3059.95
ACD/LogD (pH 7.4): 3.88
ACD/BCF (pH 7.4): 519.99
ACD/KOC (pH 7.4): 3059.91
Polar Surface Area: 197 Å2
Polarizability: 74.0±0.5 10-24cm3
Surface Tension: 66.9±5.0 dyne/cm
Molar Volume: 535.6±5.0 cm3

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