ChemSpider 2D Image | Kalopanaxsaponin G | C48H78O18

Kalopanaxsaponin G

  • Molecular FormulaC48H78O18
  • Average mass943.122 Da
  • Monoisotopic mass942.518799 Da
  • ChemSpider ID150005

  • defined stereocentres - 24 of 24 defined stereocentres

More details:

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

6-Deoxy-α-L-mannopyranosyl-(1->4)-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3,23-dihydroxy-28-oxoolean-12-en-28-yl]-β-D-glucopyranose [ACD/IUPAC Name]
6-Desoxy-α-L-mannopyranosyl-(1->4)-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3,23-dihydroxy-28-oxoolean-12-en-28-yl]-β-D-glucopyranose [German] [ACD/IUPAC Name]
6-Désoxy-α-L-mannopyranosyl-(1->4)-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3,23-dihydroxy-28-oxooléan-12-én-28-yl]-β-D-glucopyranose [French] [ACD/IUPAC Name]
Kalopanaxsaponin G
β-D-Glucopyranose, O-6-deoxy-α-L-mannopyranosyl-(1->4)-O-β-D-glucopyranosyl-(1->6)-1-O-[(3β)-3,23-dihydroxy-28-oxoolean-12-en-28-yl]- [ACD/Index Name]
57539-70-5 [RN]
Cussonoside A
Hederagenin 28-O-(rhamnopyranosyl(1-4)glucopyranosyl(1-6))glucopyranosyl ester
Olean-12-en-28-oic acid, 3,23-dihydroxy-, O-6-deoxy-α-L-mannopyranosyl-(1-4)-O-β-D-glucopyranosyl-(1-6)-β-D-glucopyranosyl ester, (3β,4α)-
Sieboldianoside 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: 1001.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 165.6±6.0 kJ/mol
Flash Point: 283.9±27.8 °C
Index of Refraction: 1.623
Molar Refractivity: 234.7±0.4 cm3
#H bond acceptors: 18
#H bond donors: 11
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 3
ACD/LogP: 4.69
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 196.40
ACD/KOC (pH 5.5): 1523.19
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 196.39
ACD/KOC (pH 7.4): 1523.17
Polar Surface Area: 295 Å2
Polarizability: 93.1±0.5 10-24cm3
Surface Tension: 74.3±5.0 dyne/cm
Molar Volume: 665.7±5.0 cm3

Click to predict properties on the Chemicalize site


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