ChemSpider 2D Image | 5,14-Dihydroxy-2,9,26-trimethyl-4,10,22,29-tetraoxo-3,19,23,28-tetraoxaoctacyclo[16.9.1.1~18,27~.0~1,5~.0~2,24~.0~8,17~.0~9,14~.0~21,26~]nonacos-11-en-16-yl acetate | C30H34O12

5,14-Dihydroxy-2,9,26-trimethyl-4,10,22,29-tetraoxo-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-en-16-yl acetate

  • Molecular FormulaC30H34O12
  • Average mass586.584 Da
  • Monoisotopic mass586.205017 Da
  • ChemSpider ID35013390

More details:

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

5,14-Dihydroxy-2,9,26-trimethyl-4,10,22,29-tetraoxo-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-en-16-yl acetate [ACD/IUPAC Name]
5,14-Dihydroxy-2,9,26-trimethyl-4,10,22,29-tetraoxo-3,19,23,28-tetraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-en-16-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 5,14-dihydroxy-2,9,26-triméthyl-4,10,22,29-tétraoxo-3,19,23,28-tétraoxaoctacyclo[16.9.1.118,27.01,5.02,24.08,17.09,14.021,26]nonacos-11-én-16-yle [French] [ACD/IUPAC Name]
5,14-dihydroxy-2,9,26-trimethyl-4,10,22,29-tetraoxo-3,19,23,28-tetraoxaoctacyclo[16.9.1.1�8,�7.0�,5.0�,�4.08,�7.0?,�4.0��,�6]nonacos-11-en-16-yl acetate
Physalin E acetate

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.646
Molar Refractivity: 136.8±0.4 cm3
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 2
ACD/LogP: 1.10
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.52
ACD/KOC (pH 5.5): 47.07
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.52
ACD/KOC (pH 7.4): 47.06
Polar Surface Area: 172 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 74.3±5.0 dyne/cm
Molar Volume: 377.1±5.0 cm3

Click to predict properties on the Chemicalize site


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