Found 1 result

Search term: MCSXGAOWFIDDIO (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (2R,3R,4S,5R)-N-(2-Amino-2-oxoethyl)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnonanamide | C14H28N2O6

(2R,3R,4S,5R)-N-(2-Amino-2-oxoethyl)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnonanamide

  • Molecular FormulaC14H28N2O6
  • Average mass320.382 Da
  • Monoisotopic mass320.194733 Da
  • ChemSpider ID61713074
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

(2R,3R,4S,5R)-N-(2-Amino-2-oxoethyl)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnonanamid [German] [ACD/IUPAC Name]
(2R,3R,4S,5R)-N-(2-Amino-2-oxoethyl)-3,4,5-trihydroxy-2-methoxy-8,8-dimethylnonanamide [ACD/IUPAC Name]
(2R,3R,4S,5R)-N-(2-Amino-2-oxoéthyl)-3,4,5-trihydroxy-2-méthoxy-8,8-diméthylnonanamide [French] [ACD/IUPAC Name]
(E,2r,3r,4s,5r)-N-(2-Azanyl-2-Oxidanylidene-Ethyl)-2-Methoxy-8,8-Dimethyl-3,4,5-Tris(Oxidanyl)non-6-Enamide
Y16

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 653.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.4 mmHg at 25°C
Enthalpy of Vaporization: 110.2±6.0 kJ/mol
Flash Point: 348.7±31.5 °C
Index of Refraction: 1.513
Molar Refractivity: 80.2±0.3 cm3
#H bond acceptors: 8
#H bond donors: 6
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 0.54
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.32
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 14.32
Polar Surface Area: 142 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 266.8±3.0 cm3

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