ChemSpider 2D Image | PENDETIDE | C31H47N7O14

PENDETIDE

  • Molecular FormulaC31H47N7O14
  • Average mass741.743 Da
  • Monoisotopic mass741.318115 Da
  • ChemSpider ID16737038
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

148805-91-8 [RN]
7017
Glycyl-L-tyrosyl-N6-[N-(2-{2-[bis(carboxymethyl)amino]ethyl(carboxymethyl)amino}ethyl)-N-(carboxymethyl)glycyl]-L-lysine
L-Lysine, N6-[N-[2-[[2-[bis(carboxymethyl)amino]ethyl](carboxymethyl)amino]ethyl]-N-(carboxymethyl)glycyl]-N2-(glycyl-L-tyrosyl)- [ACD/Index Name]
N6-[N-{2-[{2-[Bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino]ethyl}-N-(carboxymethyl)glycyl]-N2-(glycyl-L-tyrosyl)-L-lysin [German] [ACD/IUPAC Name]
N6-[N-{2-[{2-[Bis(carboxymethyl)amino]ethyl}(carboxymethyl)amino]ethyl}-N-(carboxymethyl)glycyl]-N2-(glycyl-L-tyrosyl)-L-lysine [ACD/IUPAC Name]
N6-[N-{2-[{2-[Bis(carboxyméthyl)amino]éthyl}(carboxyméthyl)amino]éthyl}-N-(carboxyméthyl)glycyl]-N2-(glycyl-L-tyrosyl)-L-lysine [French] [ACD/IUPAC Name]
pendetida [Spanish] [INN]
pendétide [French] [INN]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

60C8D1C9UJ [DBID]
UNII:60C8D1C9UJ [DBID]
UNII-60C8D1C9UJ [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1177.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 182.5±3.0 kJ/mol
Flash Point: 665.7±34.3 °C
Index of Refraction: 1.602
Molar Refractivity: 177.6±0.3 cm3
#H bond acceptors: 21
#H bond donors: 11
#Freely Rotating Bonds: 28
#Rule of 5 Violations: 3
ACD/LogP: 0.12
ACD/LogD (pH 5.5): -6.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 330 Å2
Polarizability: 70.4±0.5 10-24cm3
Surface Tension: 75.0±3.0 dyne/cm
Molar Volume: 517.5±3.0 cm3

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