ChemSpider 2D Image | 7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside | C27H30O14

7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside

  • Molecular FormulaC27H30O14
  • Average mass578.519 Da
  • Monoisotopic mass578.163574 Da
  • ChemSpider ID24740697

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de 7-hydroxy-2-(4-hydroxyphényl)-4-oxo-4H-chromén-5-yle [French] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 5-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-7-hydroxy-2-(4-hydroxyphenyl)- [ACD/Index Name]
7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
7-Hydroxy-2-(4-hydroxyphenyl)-4-oxo-4H-chromen-5-yl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
850630-40-9 [RN]
Apigenin 5-O-neohesperidoside

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

Density: 1.7±0.0 g/cm3
Boiling Point: 937.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 142.9±0.0 kJ/mol
Flash Point: 312.5±0.0 °C
Index of Refraction: 1.726
Molar Refractivity: 135.3±0.0 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 3
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 15.62
ACD/KOC (pH 5.5): 240.88
ACD/LogD (pH 7.4): 0.92
ACD/BCF (pH 7.4): 1.67
ACD/KOC (pH 7.4): 25.74
Polar Surface Area: 225 Å2
Polarizability: 53.7±0.0 10-24cm3
Surface Tension: 104.9±0.0 dyne/cm
Molar Volume: 340.4±0.0 cm3

Click to predict properties on the Chemicalize site


Advertisement