ChemSpider 2D Image | 20-hydroxyecdysone 22-phosphate | C27H45O10P

20-hydroxyecdysone 22-phosphate

  • Molecular FormulaC27H45O10P
  • Average mass560.614 Da
  • Monoisotopic mass560.275024 Da
  • ChemSpider ID19984405

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2β,3β,5β,22R)-2,3,14,20,25-Pentahydroxy-22-(phosphonooxy)cholest-7-en-6-one
(2β,3β,5β,22R)-2,3,14,20,25-Pentahydroxy-6-oxocholest-7-en-22-yl dihydrogen phosphate [ACD/IUPAC Name]
(2β,3β,5β,22R)-2,3,14,20,25-Pentahydroxy-6-oxocholest-7-en-22-yldihydrogenphosphat [German] [ACD/IUPAC Name]
20-hydroxyecdysone 22-phosphate
86577-97-1 [RN]
Cholest-7-en-6-one, 2,3,14,20,25-pentahydroxy-22-(phosphonooxy)-, (2β,3β,5β,22R)- [ACD/Index Name]
Dihydrogénophosphate de (2β,3β,5β,22R)-2,3,14,20,25-pentahydroxy-6-oxocholest-7-én-22-yle [French] [ACD/IUPAC Name]
(22R)-2β,3β,14,20,25-pentahydroxy-6-oxo-5β-cholest-7-en-22-yl dihydrogen phosphate
20-hydroxyecdysone-22-phosphate
2β,3β,5β,22R-2,3,14,20,25-pentahydroxy-22-(phosphonooxy)-cholest-7-en-6-one

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

Density: 1.4±0.1 g/cm3
Boiling Point: 791.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.2±6.0 kJ/mol
Flash Point: 432.4±35.7 °C
Index of Refraction: 1.599
Molar Refractivity: 137.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: -0.87
ACD/LogD (pH 5.5): -3.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 195 Å2
Polarizability: 54.6±0.5 10-24cm3
Surface Tension: 68.8±5.0 dyne/cm
Molar Volume: 403.7±5.0 cm3

Click to predict properties on the Chemicalize site


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