ChemSpider 2D Image | Vinaginsenoside R25 | C42H70O15

Vinaginsenoside R25

  • Molecular FormulaC42H70O15
  • Average mass814.996 Da
  • Monoisotopic mass814.471497 Da
  • ChemSpider ID8804610
  • defined stereocentres - 21 of 21 defined stereocentres


More details:






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

(3β,6α,12β)-20-(β-D-Glucopyranosyloxy)-3,12-dihydroxy-24-oxodammar-25-en-6-yl β-D-glucopyranoside [ACD/IUPAC Name]
(3β,6α,12β)-20-(β-D-Glucopyranosyloxy)-3,12-dihydroxy-24-oxodammar-25-en-6-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
Dammar-25-en-24-one, 6,20-bis(β-D-glucopyranosyloxy)-3,12-dihydroxy-, (3β,6α,12β)- [ACD/Index Name]
Vinaginsenoside R25
β-D-Glucopyranoside de (3β,6α,12β)-20-(β-D-glucopyranosyloxy)-3,12-dihydroxy-24-oxodammar-25-én-6-yle [French] [ACD/IUPAC Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL503328/

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

Density: 1.4±0.1 g/cm3
Boiling Point: 930.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 153.5±6.0 kJ/mol
Flash Point: 271.8±27.8 °C
Index of Refraction: 1.604
Molar Refractivity: 205.9±0.4 cm3
#H bond acceptors: 15
#H bond donors: 10
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -0.25
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 29.04
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 29.04
Polar Surface Area: 256 Å2
Polarizability: 81.6±0.5 10-24cm3
Surface Tension: 68.7±5.0 dyne/cm
Molar Volume: 599.0±5.0 cm3

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