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Search term: C[C@@H](O[C@H]1[C@H](O)[C@@H](CO)O[C@@H](O)[C@@H]1NC(C)=O)C(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | N-acetyl-beta-muramic acid | C11H19NO8

N-acetyl-β-muramic acid

  • Molecular FormulaC11H19NO8
  • Average mass293.271 Da
  • Monoisotopic mass293.111053 Da
  • ChemSpider ID21865412

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

2-Acetamido-3-O-[(1R)-1-carboxyethyl]-2-deoxy-β-D-glucopyranose [ACD/IUPAC Name]
2-Acetamido-3-O-[(1R)-1-carboxyethyl]-2-desoxy-β-D-glucopyranose [German] [ACD/IUPAC Name]
2-Acétamido-3-O-[(1R)-1-carboxyéthyl]-2-désoxy-β-D-glucopyranose [French] [ACD/IUPAC Name]
61665-31-4 [RN]
N-acetyl-β-muramic acid
β-D-Glucopyranose, 2-(acetylamino)-3-O-[(1R)-1-carboxyethyl]-2-deoxy- [ACD/Index Name]
(R)-2-(((2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl)oxy)propanoic acid
(R)-2-(((2R,3R,4R,5S,6R)-3-acetamido-2,5-dihydroxy-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl)oxy)propanoic acid(WXG01687)
2-(acetylamino)-3-O-[(1R)-1-carboxyethyl]-2-deoxy-β-D-glucopyranose
6373636 [Beilstein]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

TQ9990Q808 [DBID]

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 696.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±5.0 mmHg at 25°C
    Enthalpy of Vaporization: 116.6±6.0 kJ/mol
    Flash Point: 375.0±31.5 °C
    Index of Refraction: 1.558
    Molar Refractivity: 64.3±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 5
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: -1.59
    ACD/LogD (pH 5.5): -3.46
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -4.90
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 146 Å2
    Polarizability: 25.5±0.5 10-24cm3
    Surface Tension: 69.5±5.0 dyne/cm
    Molar Volume: 199.6±5.0 cm3

    Click to predict properties on the Chemicalize site


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