Found 3 results

Search term: MF = 'C_{37}H_{72}N_{2}O_{10}'
ChemSpider 2D Image | Ethyl {(2R,3R,26R,27R)-27-amino-26-[(5xi)-alpha-L-arabino-hexopyranosyloxy]-3-hydroxy-11-oxo-2-octacosanyl}carbamate | C37H72N2O10

Ethyl {(2R,3R,26R,27R)-27-amino-26-[(5ξ)-α-L-arabino-hexopyranosyloxy]-3-hydroxy-11-oxo-2-octacosanyl}carbamate

  • Molecular FormulaC37H72N2O10
  • Average mass704.975 Da
  • Monoisotopic mass704.518677 Da
  • ChemSpider ID10480548

  • defined stereocentres - 6 of 9 defined stereocentres

More details:

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

{(2R,3R,26R,27R)-27-Amino-26-[(5ξ)-α-L-arabino-hexopyranosyloxy]-3-hydroxy-11-oxo-2-octacosanyl}carbamate d'éthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[(1R,2R,25R,26R)-26-amino-25-[(5ξ)-α-L-arabino-hexopyranosyloxy]-2-hydroxy-1-methyl-10-oxoheptacosyl]-, ethyl ester [ACD/Index Name]
Ethyl {(2R,3R,26R,27R)-27-amino-26-[(5ξ)-α-L-arabino-hexopyranosyloxy]-3-hydroxy-11-oxo-2-octacosanyl}carbamate [ACD/IUPAC Name]
Ethyl-{(2R,3R,26R,27R)-27-amino-26-[(5ξ)-α-L-arabino-hexopyranosyloxy]-3-hydroxy-11-oxo-2-octacosanyl}carbamat [German] [ACD/IUPAC Name]
rhizochalin A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 836.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 138.2±6.0 kJ/mol
Flash Point: 459.5±34.3 °C
Index of Refraction: 1.523
Molar Refractivity: 191.5±0.4 cm3
#H bond acceptors: 12
#H bond donors: 8
#Freely Rotating Bonds: 31
#Rule of 5 Violations: 4
ACD/LogP: 5.28
ACD/LogD (pH 5.5): 1.63
ACD/BCF (pH 5.5): 2.02
ACD/KOC (pH 5.5): 8.45
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 51.40
ACD/KOC (pH 7.4): 215.12
Polar Surface Area: 201 Å2
Polarizability: 75.9±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 626.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement