ChemSpider 2D Image | (1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.1~11,15~]triaconta-6,20-diene-8,22-dione (non-preferred name) | C32H48O14

(1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.111,15]triaconta-6,20-diene-8,22-dione (non-preferred name)

  • Molecular FormulaC32H48O14
  • Average mass656.715 Da
  • Monoisotopic mass656.304382 Da
  • ChemSpider ID10142271

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 10 of 12 defined stereocentres

More details:

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

(1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.111,15]triaconta-6,20-dien-8,22-dion (non-preferred n ame) [German] [ACD/IUPAC Name]
(1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tetramethyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.111,15]triaconta-6,20-diene-8,22-dione (non-preferred name) [ACD/IUPAC Name]
(1S,11R,12S,13R,14R,15S,25R,26S,27R,28R)-12,13,14,26,27,28-Hexahydroxy-3,7,17,21-tétraméthyl-3,17-divinyl-2,9,16,23,29,30-hexaoxatricyclo[23.3.1.111,15]triaconta-6,20-diène-8,22-dione (non-preferred name) [French] [ACD/IUPAC Name]
Dicliripariside A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 864.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.8±6.0 kJ/mol
Flash Point: 270.0±27.8 °C
Index of Refraction: 1.554
Molar Refractivity: 165.6±0.3 cm3
#H bond acceptors: 14
#H bond donors: 6
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 1.99
ACD/BCF (pH 5.5): 19.20
ACD/KOC (pH 5.5): 288.60
ACD/LogD (pH 7.4): 1.99
ACD/BCF (pH 7.4): 19.20
ACD/KOC (pH 7.4): 288.59
Polar Surface Area: 211 Å2
Polarizability: 65.7±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 516.5±3.0 cm3

Click to predict properties on the Chemicalize site


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