ChemSpider 2D Image | 2,6-Anhydro-1-deoxy-5-O-(6-deoxyhexopyranosyl)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-oxido-4-oxo-4H-chromen-6-yl]hex-3-ulose | C27H27O14

2,6-Anhydro-1-deoxy-5-O-(6-deoxyhexopyranosyl)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-oxido-4-oxo-4H-chromen-6-yl]hex-3-ulose

  • Molecular FormulaC27H27O14
  • Average mass575.495 Da
  • Monoisotopic mass575.140625 Da
  • ChemSpider ID24785042

  • Charge - Charge

More details:

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

2,6-Anhydro-1-deoxy-5-O-(6-deoxyhexopyranosyl)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-oxido-4-oxo-4H-chromen-6-yl]hex-3-ulose [ACD/IUPAC Name]
2,6-Anhydro-1-désoxy-5-O-(6-désoxyhexopyranosyl)-6-[2-(3,4-dihydroxyphényl)-5-hydroxy-4-oxo-7-oxydo-4H-chromén-6-yl]hex-3-ulose [French] [ACD/IUPAC Name]
2,6-Anhydro-1-desoxy-5-O-(6-desoxyhexopyranosyl)-6-[2-(3,4-dihydroxyphenyl)-5-hydroxy-7-oxido-4-oxo-4H-chromen-6-yl]hex-3-ulose [German] [ACD/IUPAC Name]
3-Hexulose, 2,6-anhydro-1-deoxy-5-O-(6-deoxyhexopyranosyl)-6-C-[2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-6-yl]-, ion(1-) [ACD/Index Name]
2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-6-[4-hydroxy-6-methyl-5-oxo-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxyoxan-2-yl]chromen-4-one
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point: 938.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 143.1±3.0 kJ/mol
Flash Point: 313.7±27.8 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 3
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 0.83
ACD/BCF (pH 5.5): 2.18
ACD/KOC (pH 5.5): 51.62
ACD/LogD (pH 7.4): -1.10
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 236 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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