ChemSpider 2D Image | 88H869LO4X | C51H54O34

88H869LO4X

  • Molecular FormulaC51H54O34
  • Average mass1210.954 Da
  • Monoisotopic mass1210.249634 Da
  • ChemSpider ID8639467
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






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

2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl 2,3,4-tris-O-(3-carboxypropanoyl)-6-O-[2,3,4-tris-O-(3-carboxypropanoyl)-6-deoxy-α-L-mannopyranosyl]-β-D-glucopyranoside [ACD/IUPAC Name]
2-(3,4-Dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-chromen-3-yl-2,3,4-tris-O-(3-carboxypropanoyl)-6-O-[2,3,4-tris-O-(3-carboxypropanoyl)-6-desoxy-α-L-mannopyranosyl]-β-D-glucopyranosid [German] [ACD/IUPAC Name]
2,3,4-Tris-O-(3-carboxypropanoyl)-6-O-[2,3,4-tris-O-(3-carboxypropanoyl)-6-désoxy-α-L-mannopyranosyl]-β-D-glucopyranoside de 2-(3,4-dihydroxyphényl)-5,7-dihydroxy-4-oxo-4H-chromén-3-yle [French] [ACD/IUPAC Name]
267006-02-0 [RN]
88H869LO4X
β-D-Glucopyranoside, 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-4-oxo-4H-1-benzopyran-3-yl 6-O-[2,3,4-tris-O-(3-carboxy-1-oxopropyl)-6-deoxy-α-L-mannopyranosyl]-, tris(3-carboxypropanoate) [ACD/Index Name]
RUTINYL SUCCINATE
UNII:88H869LO4X
UNII-88H869LO4X

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

Density: 1.7±0.1 g/cm3
Boiling Point: 1316.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 207.4±3.0 kJ/mol
Flash Point: 368.5±27.8 °C
Index of Refraction: 1.655
Molar Refractivity: 261.2±0.4 cm3
#H bond acceptors: 34
#H bond donors: 10
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 3
ACD/LogP: 2.75
ACD/LogD (pH 5.5): -5.23
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 526 Å2
Polarizability: 103.5±0.5 10-24cm3
Surface Tension: 102.2±5.0 dyne/cm
Molar Volume: 712.0±5.0 cm3

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