ChemSpider 2D Image | 5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-alpha-D-glucopyranoside | C28H32O14

5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranoside

  • Molecular FormulaC28H32O14
  • Average mass592.545 Da
  • Monoisotopic mass592.179199 Da
  • ChemSpider ID5140923
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






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

4H-1-Benzopyran-4-one, 7-[[6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranosyl]oxy]-5-hydroxy-2-(4-methoxyphenyl)- [ACD/Index Name]
5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl 6-O-(6-deoxy-α-L-mannopyranosyl)-α-D-glucopyranoside [ACD/IUPAC Name]
5-Hydroxy-2-(4-methoxyphenyl)-4-oxo-4H-chromen-7-yl-6-O-(6-desoxy-α-L-mannopyranosyl)-α-D-glucopyranosid [German] [ACD/IUPAC Name]
6-O-(6-Désoxy-α-L-mannopyranosyl)-α-D-glucopyranoside de 5-hydroxy-2-(4-méthoxyphényl)-4-oxo-4H-chromén-7-yle [French] [ACD/IUPAC Name]
Buddleoflavonoloside

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

DivK1c_006862 [DBID]
KBio1_001806 [DBID]
KBio2_000682 [DBID]
KBio2_003250 [DBID]
KBio2_005818 [DBID]
KBio3_001127 [DBID]
KBioGR_002354 [DBID]
KBioSS_000682 [DBID]
SDCCGMLS-0066936.P001 [DBID]
SPBio_000622 [DBID]
More...

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 885.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.8±3.0 kJ/mol
Flash Point: 292.2±27.8 °C
Index of Refraction: 1.694
Molar Refractivity: 140.2±0.4 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: 2.10
ACD/LogD (pH 5.5): 0.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 31.42
ACD/LogD (pH 7.4): -0.92
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.90
Polar Surface Area: 214 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 92.6±5.0 dyne/cm
Molar Volume: 365.2±5.0 cm3

Click to predict properties on the Chemicalize site





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