ChemSpider 2D Image | beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GalpNAc(1-) | C14H20NO11

β-D-4-deoxy-δ(4)-GlcpA-(1->3)-β-D-GalpNAc(1-)

  • Molecular FormulaC14H20NO11
  • Average mass378.309 Da
  • Monoisotopic mass378.104187 Da
  • ChemSpider ID26333061
  • Charge - Charge

    defined stereocentres - 8 of 8 defined stereocentres


More details:






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

2-Acetamido-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranuronosyl)-β-D-galactopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-3-O-(4-desoxy-α-L-threo-hex-4-enopyranuronosyl)-β-D-galactopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-3-O-(4-désoxy-α-L-thréo-hex-4-énopyranuronosyl)-β-D-galactopyranose [French] [ACD/IUPAC Name]
β-D-4-deoxy-δ(4)-GlcpA-(1->3)-β-D-GalpNAc(1-)
β-D-Galactopyranose, 2-(acetylamino)-2-deoxy-3-O-(4-deoxy-α-L-threo-hex-4-enopyranuronosyl)-, ion(1-) [ACD/Index Name]
missing
β-D-4-deoxy-δ(4)-GlcpA-(1->3)-β-D-GalpNAc

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

CHEBI:63263 [DBID]
  • Miscellaneous
    • Chemical Class:

      A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of beta-D-4-deoxy-Delta(4)-GlcpA-(1->3)-beta-D-GalpNAc. ChEBI CHEBI:63263
      A monocarboxylic acid anion resulting from the removal of a proton from the carboxy group of beta-D-4-deoxy-Delta4-Glcp; A-(1right3)-beta-D-GalpNAc. ChEBI CHEBI:63263

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

Density:
Boiling Point: 818.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.3±6.0 kJ/mol
Flash Point: 448.5±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: -1.53
ACD/LogD (pH 5.5): -4.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 198 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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