Found 22 results

Search term: MF = 'C_{43}H_{66}O_{11}'
ChemSpider 2D Image | (3beta,5alpha,25R)-12-Oxospirost-9(11)-en-3-yl 3,6-bis-O-(2,2-dimethylpropanoyl)-beta-D-glucopyranoside | C43H66O11

(3β,5α,25R)-12-Oxospirost-9(11)-en-3-yl 3,6-bis-O-(2,2-dimethylpropanoyl)-β-D-glucopyranoside

  • Molecular FormulaC43H66O11
  • Average mass758.977 Da
  • Monoisotopic mass758.460510 Da
  • ChemSpider ID28529366

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(3β,5α,25R)-12-Oxospirost-9(11)-en-3-yl 3,6-bis-O-(2,2-dimethylpropanoyl)-β-D-glucopyranoside [ACD/IUPAC Name]
(3β,5α,25R)-12-Oxospirost-9(11)-en-3-yl-3,6-bis-O-(2,2-dimethylpropanoyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
3,6-Bis-O-(2,2-diméthylpropanoyl)-β-D-glucopyranoside de (3β,5α,25R)-12-oxospirost-9(11)-én-3-yle [French] [ACD/IUPAC Name]
Spirost-9(11)-en-12-one, 3-[[3,6-bis-O-(2,2-dimethyl-1-oxopropyl)-β-D-glucopyranosyl]oxy]-, (3β,5α,25R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 795.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.3 mmHg at 25°C
Enthalpy of Vaporization: 131.9±6.0 kJ/mol
Flash Point: 229.8±26.4 °C
Index of Refraction: 1.559
Molar Refractivity: 200.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: 6.65
ACD/LogD (pH 5.5): 6.32
ACD/BCF (pH 5.5): 37165.08
ACD/KOC (pH 5.5): 64995.94
ACD/LogD (pH 7.4): 6.32
ACD/BCF (pH 7.4): 37164.39
ACD/KOC (pH 7.4): 64994.73
Polar Surface Area: 147 Å2
Polarizability: 79.4±0.5 10-24cm3
Surface Tension: 51.0±5.0 dyne/cm
Molar Volume: 619.8±5.0 cm3

Click to predict properties on the Chemicalize site


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