Found 22 results

Search term: MF = 'C_{40}H_{51}NO_{13}'
ChemSpider 2D Image | Methyl 2-O-{(8R,9R)-8-acetoxy-10-[(4R)-4-isopropyl-2-oxo-1,3-oxazolidin-3-yl]-9-methyl-4,7,10-trioxo-5-decen-1-yl}-3,4-di-O-benzyl-alpha-D-mannopyranoside | C40H51NO13

Methyl 2-O-{(8R,9R)-8-acetoxy-10-[(4R)-4-isopropyl-2-oxo-1,3-oxazolidin-3-yl]-9-methyl-4,7,10-trioxo-5-decen-1-yl}-3,4-di-O-benzyl-α-D-mannopyranoside

  • Molecular FormulaC40H51NO13
  • Average mass753.832 Da
  • Monoisotopic mass753.336060 Da
  • ChemSpider ID5141470

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

2-O-{(8R,9R)-8-Acétoxy-10-[(4R)-4-isopropyl-2-oxo-1,3-oxazolidin-3-yl]-9-méthyl-4,7,10-trioxo-5-décén-1-yl}-3,4-di-O-benzyl-α-D-mannopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl 2-O-{(8R,9R)-8-acetoxy-10-[(4R)-4-isopropyl-2-oxo-1,3-oxazolidin-3-yl]-9-methyl-4,7,10-trioxo-5-decen-1-yl}-3,4-di-O-benzyl-α-D-mannopyranoside [ACD/IUPAC Name]
Methyl-2-O-{(8R,9R)-8-acetoxy-10-[(4R)-4-isopropyl-2-oxo-1,3-oxazolidin-3-yl]-9-methyl-4,7,10-trioxo-5-decen-1-yl}-3,4-di-O-benzyl-α-D-mannopyranosid [German] [ACD/IUPAC Name]
α-D-Mannopyranoside, methyl 2-O-[(8R,9R)-8-(acetyloxy)-9-methyl-10-[(4R)-4-(1-methylethyl)-2-oxo-3-oxazolidinyl]-4,7,10-trioxo-5-decen-1-yl]-3,4-bis-O-(phenylmethyl)- [ACD/Index Name]
Fold1.1_001956
Fold1.1_002512

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

Fold1_000197 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 863.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 131.5±3.0 kJ/mol
Flash Point: 476.2±34.3 °C
Index of Refraction: 1.571
Molar Refractivity: 194.9±0.4 cm3
#H bond acceptors: 14
#H bond donors: 1
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 3
ACD/LogP: 5.82
ACD/LogD (pH 5.5): 4.98
ACD/BCF (pH 5.5): 3596.68
ACD/KOC (pH 5.5): 12215.42
ACD/LogD (pH 7.4): 4.98
ACD/BCF (pH 7.4): 3596.68
ACD/KOC (pH 7.4): 12215.42
Polar Surface Area: 173 Å2
Polarizability: 77.3±0.5 10-24cm3
Surface Tension: 55.7±5.0 dyne/cm
Molar Volume: 593.4±5.0 cm3

Click to predict properties on the Chemicalize site


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