ChemSpider 2D Image | Beesioside A | C35H58O9

Beesioside A

  • Molecular FormulaC35H58O9
  • Average mass622.830 Da
  • Monoisotopic mass622.408081 Da
  • ChemSpider ID10119001

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

(3β,9β,16β,24R)-16,18,25-Trihydroxy-20,24-epoxy-9,19-cyclolanostan-3-yl β-D-xylopyranoside [ACD/IUPAC Name]
(3β,9β,16β,24R)-16,18,25-Trihydroxy-20,24-epoxy-9,19-cyclolanostan-3-yl-β-D-xylopyranosid [German] [ACD/IUPAC Name]
Beesioside A
β-D-Xylopyranoside de (3β,9β,16β,24R)-16,18,25-trihydroxy-20,24-époxy-9,19-cyclolanostan-3-yle [French] [ACD/IUPAC Name]
β-D-Xylopyranoside, (3β,9β,16β,24R)-20,24-epoxy-16,18,25-trihydroxy-9,19-cyclolanostan-3-yl [ACD/Index Name]

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

ZINC08382466 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 750.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.7 mmHg at 25°C
Enthalpy of Vaporization: 124.7±6.0 kJ/mol
Flash Point: 407.4±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 164.1±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 4.25
ACD/LogD (pH 5.5): 3.38
ACD/BCF (pH 5.5): 217.06
ACD/KOC (pH 5.5): 1637.32
ACD/LogD (pH 7.4): 3.38
ACD/BCF (pH 7.4): 217.06
ACD/KOC (pH 7.4): 1637.31
Polar Surface Area: 149 Å2
Polarizability: 65.1±0.5 10-24cm3
Surface Tension: 62.0±5.0 dyne/cm
Molar Volume: 478.4±5.0 cm3

Click to predict properties on the Chemicalize site


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