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ChemSpider 2D Image | 2-Acetamido-2-deoxy-3-O-beta-D-glucopyranuronosyl-4-O-sulfonato-beta-D-galactopyranose | C14H21NO15S

2-Acetamido-2-deoxy-3-O-β-D-glucopyranuronosyl-4-O-sulfonato-β-D-galactopyranose

  • Molecular FormulaC14H21NO15S
  • Average mass475.380 Da
  • Monoisotopic mass475.064301 Da
  • ChemSpider ID30776543

  • Charge - Charge

    defined stereocentres - 10 of 10 defined stereocentres

More details:

Date of deprecation: 10:11, Aug 26, 2015
Reason for deprecation: Deprecate record: there are no supporting data sources.

If you believe this record was deprecated in error, please use the Comment on this record button to contact the ChemSpider team.

Common reasons for deprecation are:
  • Chemically impossible structures (eg. incorrect valence atoms)
  • Lack of any linking data sources
  • Poor depiction of a structure that is already in ChemSpider

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

2-Acetamido-2-deoxy-3-O-β-D-glucopyranuronosyl-4-O-sulfonato-β-D-galactopyranose [ACD/IUPAC Name]
2-Acetamido-2-desoxy-3-O-β-D-glucopyranuronosyl-4-O-sulfonato-β-D-galactopyranose [German] [ACD/IUPAC Name]
2-Acétamido-2-désoxy-3-O-β-D-glucopyranuronosyl-4-O-sulfonato-β-D-galactopyranose [French] [ACD/IUPAC Name]
β-D-Galactopyranose, 2-(acetylamino)-2-deoxy-3-O-β-D-glucopyranuronosyl-, 4-(hydrogen sulfate), ion(2-) [ACD/Index Name]
(2S,3S,4S,5R,6R)-6-{[(2R,3R,4R,5R,6R)-3-acetamido-2-hydroxy-6-(hydroxymethyl)-5-(sulfonatooxy)oxan-4-yl]oxy}-3,4,5-trihydroxyoxane-2-carboxylate
Chondroitin 4'-sulfate
Chondroitin 4-sulfate
chondroitin 4'-sulfate anion
chondroitin 4'-sulfate(2-)
Chondroitin 4'-sulphate
More...
  • Miscellaneous

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 16
#H bond donors: 8
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -4.47
ACD/LogD (pH 5.5): -9.65
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -9.67
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 273 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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