ChemSpider 2D Image | Dermorphin | C40H50N8O10

Dermorphin

  • Molecular FormulaC40H50N8O10
  • Average mass802.873 Da
  • Monoisotopic mass802.364990 Da
  • ChemSpider ID4588650
  • defined stereocentres - 6 of 6 defined stereocentres


More details:






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

2SEC01B703
77614-16-5 [RN]
Dermorphin [Wiki]
H-Tyr-D-Ala-Phe-Gly-Tyr-Pro-Ser-NH2
L-Serinamide, L-tyrosyl-D-alanyl-L-phenylalanylglycyl-L-tyrosyl-L-prolyl- [ACD/Index Name]
L-Tyrosyl-D-alanyl-L-phenylalanylglycyl-L-tyrosyl-L-prolyl-L-serinamid [German] [ACD/IUPAC Name]
L-Tyrosyl-D-alanyl-L-phenylalanylglycyl-L-tyrosyl-L-prolyl-L-serinamide [ACD/IUPAC Name]
L-Tyrosyl-D-alanyl-L-phénylalanylglycyl-L-tyrosyl-L-prolyl-L-sérinamide [French] [ACD/IUPAC Name]
Tyrosyl-alanyl-phenylalanyl-glycyl-tyrosyl-prolyl-serinamide
(2S)-N-[(2S)-1-amino-3-hydroxy-1-oxopropan-2-yl]-1-[(2S)-2-[[2-[[(2S)-2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-3-phenylpropanoyl]amino]acetyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxamide
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 1323.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 208.6±3.0 kJ/mol
Flash Point: 754.4±34.3 °C
Index of Refraction: 1.628
Molar Refractivity: 209.0±0.3 cm3
#H bond acceptors: 18
#H bond donors: 12
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 3
ACD/LogP: 1.22
ACD/LogD (pH 5.5): -1.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.74
Polar Surface Area: 296 Å2
Polarizability: 82.9±0.5 10-24cm3
Surface Tension: 69.8±3.0 dyne/cm
Molar Volume: 588.8±3.0 cm3

Click to predict properties on the Chemicalize site





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