ChemSpider 2D Image | Methyl (5xi)-2-acetamido-2-deoxy-3-O-[(5xi)-4-deoxy-4-methyl-beta-D-arabino-hexopyranuronosyl]-alpha-L-xylo-hexopyranoside | C16H27NO11

Methyl (5ξ)-2-acetamido-2-deoxy-3-O-[(5ξ)-4-deoxy-4-methyl-β-D-arabino-hexopyranuronosyl]-α-L-xylo-hexopyranoside

  • Molecular FormulaC16H27NO11
  • Average mass409.386 Da
  • Monoisotopic mass409.158417 Da
  • ChemSpider ID32697339

  • defined stereocentres - 8 of 10 defined stereocentres

More details:

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

(5ξ)-2-Acétamido-2-désoxy-3-O-[(5ξ)-4-désoxy-4-méthyl-β-D-arabino-hexopyranuronosyl]-α-L-xylo-hexopyranoside de méthyle [French] [ACD/IUPAC Name]
Methyl (5ξ)-2-acetamido-2-deoxy-3-O-[(5ξ)-4-deoxy-4-methyl-β-D-arabino-hexopyranuronosyl]-α-L-xylo-hexopyranoside [ACD/IUPAC Name]
Methyl-(5ξ)-2-acetamido-2-desoxy-3-O-[(5ξ)-4-desoxy-4-methyl-β-D-arabino-hexopyranuronosyl]-α-L-xylo-hexopyranosid [German] [ACD/IUPAC Name]
α-L-xylo-Hexopyranoside, methyl 2-(acetylamino)-2-deoxy-3-O-[(5ξ)-4-deoxy-4-methyl-β-D-arabino-hexopyranuronosyl]-, (5ξ)- [ACD/Index Name]
232-678-0 [EINECS]
9004-61-9 [RN]
Hyaluronic acid
MFCD01773053 [MDL number]
MT7250000

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 756.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±5.8 mmHg at 25°C
    Enthalpy of Vaporization: 125.7±6.0 kJ/mol
    Flash Point: 411.0±32.9 °C
    Index of Refraction: 1.574
    Molar Refractivity: 90.3±0.4 cm3
    #H bond acceptors: 12
    #H bond donors: 6
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: -0.89
    ACD/LogD (pH 5.5): -3.75
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.99
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 184 Å2
    Polarizability: 35.8±0.5 10-24cm3
    Surface Tension: 71.8±5.0 dyne/cm
    Molar Volume: 273.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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