ChemSpider 2D Image | Phakellistatin 13 | C42H54N8O8

Phakellistatin 13

  • Molecular FormulaC42H54N8O8
  • Average mass798.927 Da
  • Monoisotopic mass798.406433 Da
  • ChemSpider ID9300779

  • defined stereocentres - 7 of 7 defined stereocentres

More details:

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

Cyclo(glycyl-L-prolyl-L-threonyl-L-leucyl-L-tryptophyl-L-prolyl-L-phenylalanyl) [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(glycyl-L-prolyl-L-threonyl-L-leucyl-L-tryptophyl-L-prolyl-L-phenylalanyl) [German] [ACD/Index Name] [ACD/IUPAC Name]
Cyclo(glycyl-L-prolyl-L-thréonyl-L-leucyl-L-tryptophyl-L-prolyl-L-phénylalanyl) [French] [ACD/IUPAC Name]
Phakellistatin 13 [Wiki]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1224.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 190.7±3.0 kJ/mol
Flash Point: 694.3±34.3 °C
Index of Refraction: 1.651
Molar Refractivity: 214.7±0.4 cm3
#H bond acceptors: 16
#H bond donors: 7
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 3
ACD/LogP: -1.78
ACD/LogD (pH 5.5): 0.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.82
ACD/LogD (pH 7.4): 0.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.82
Polar Surface Area: 222 Å2
Polarizability: 85.1±0.5 10-24cm3
Surface Tension: 71.2±5.0 dyne/cm
Molar Volume: 588.0±5.0 cm3

Click to predict properties on the Chemicalize site


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