Found 57 results

Search term: MF = 'C_{37}H_{58}O_{11}'
ChemSpider 2D Image | (1alpha,3beta,5xi,8xi,9beta,15alpha,23R,24S)-1,15-Dihydroxy-16-oxo-3-(beta-D-xylopyranosyloxy)-24,25-epoxy-9,19-cyclolanostan-23-yl acetate | C37H58O11

(1α,3β,5ξ,8ξ,9β,15α,23R,24S)-1,15-Dihydroxy-16-oxo-3-(β-D-xylopyranosyloxy)-24,25-epoxy-9,19-cyclolanostan-23-yl acetate

  • Molecular FormulaC37H58O11
  • Average mass678.850 Da
  • Monoisotopic mass678.397888 Da
  • ChemSpider ID8162626

  • defined stereocentres - 15 of 17 defined stereocentres

More details:

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

(1α,3β,5ξ,8ξ,9β,15α,23R,24S)-1,15-Dihydroxy-16-oxo-3-(β-D-xylopyranosyloxy)-24,25-epoxy-9,19-cyclolanostan-23-yl acetate [ACD/IUPAC Name]
(1α,3β,5ξ,8ξ,9β,15α,23R,24S)-1,15-Dihydroxy-16-oxo-3-(β-D-xylopyranosyloxy)-24,25-epoxy-9,19-cyclolanostan-23-yl-acetat [German] [ACD/IUPAC Name]
9,19-Cyclolanostan-16-one, 23-(acetyloxy)-24,25-epoxy-1,15-dihydroxy-3-(β-D-xylopyranosyloxy)-, (1α,3β,5ξ,8ξ,9β,15α,23R,24S)- [ACD/Index Name]
Acétate de (1α,3β,5ξ,8ξ,9β,15α,23R,24S)-1,15-dihydroxy-16-oxo-3-(β-D-xylopyranosyloxy)-24,25-époxy-9,19-cyclolanostan-23-yle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 777.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.1 mmHg at 25°C
Enthalpy of Vaporization: 129.0±6.0 kJ/mol
Flash Point: 235.2±26.4 °C
Index of Refraction: 1.591
Molar Refractivity: 173.7±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 3
ACD/LogP: 2.40
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 32.51
ACD/KOC (pH 5.5): 420.67
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.51
ACD/KOC (pH 7.4): 420.66
Polar Surface Area: 176 Å2
Polarizability: 68.9±0.5 10-24cm3
Surface Tension: 60.5±5.0 dyne/cm
Molar Volume: 514.1±5.0 cm3

Click to predict properties on the Chemicalize site


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