ChemSpider 2D Image | N-[1-({1-[(2',5-Dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)amino]-3-methyl-1-oxo-2-pentanyl}amino)-3-hydroxy-1-oxo-2-butanyl]-alpha-asparaginylglycylisoleucylglycylserylglutaminyl-N-(2 ',5-dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)threoninamide | C58H78N14O20

N-[1-({1-[(2',5-Dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)amino]-3-methyl-1-oxo-2-pentanyl}amino)-3-hydroxy-1-oxo-2-butanyl]-α-asparaginylglycylisoleucylglycylserylglutaminyl-N-(2 ',5-dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)threoninamide

  • Molecular FormulaC58H78N14O20
  • Average mass1291.322 Da
  • Monoisotopic mass1290.551636 Da
  • ChemSpider ID78444460

More details:

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

N-[1-({1-[(2',5-Dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)amino]-3-methyl-1-oxo-2-pentanyl}amino)-3-hydroxy-1-oxo-2-butanyl]-α-asparaginylglycylisoleucylglycylserylglutaminyl-N-(2 ',5-dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)threoninamid [German] [ACD/IUPAC Name]
N-[1-({1-[(2',5-Dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)amino]-3-methyl-1-oxo-2-pentanyl}amino)-3-hydroxy-1-oxo-2-butanyl]-α-asparaginylglycylisoleucylglycylserylglutaminyl-N-(2 ',5-dioxo-1',2',4,5-tetrahydro-3H-spiro[furan-2,3'-indol]-4-yl)threoninamide [ACD/IUPAC Name]
N-[1-({1-[(2',5-Dioxo-1',2',4,5-tétrahydro-3H-spiro[furan-2,3'-indol]-4-yl)amino]-3-méthyl-1-oxo-2-pentanyl}amino)-3-hydroxy-1-oxo-2-butanyl]-α-asparaginylglycylisoleucylglycylsérylglutaminyl-N-(2 ',5-dioxo-1',2',4,5-tétrahydro-3H-spiro[furan-2,3'-indol]-4-yl)thréoninamide [French] [ACD/IUPAC Name]
Threoninamide, N-[2-hydroxy-1-[[[2-methyl-1-[[(1',2',4,5-tetrahydro-2',5-dioxospiro[furan-2(3H),3'-[3H]indol]-4-yl)amino]carbonyl]butyl]amino]carbonyl]propyl]-α-asparaginylglycylisoleucylglycylser ylglutaminyl-N-(1',2',4,5-tetrahydro-2',5-dioxospiro[furan-2(3H),3'-[3H]indol]-4-yl)- [ACD/Index Name]
Achromosin

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

Density: 1.5±0.1 g/cm3
Boiling Point: 1845.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 314.0±3.0 kJ/mol
Flash Point: 1070.1±34.3 °C
Index of Refraction: 1.648
Molar Refractivity: 316.9±0.4 cm3
#H bond acceptors: 34
#H bond donors: 19
#Freely Rotating Bonds: 31
#Rule of 5 Violations: 3
ACD/LogP: -2.51
ACD/LogD (pH 5.5): -5.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 532 Å2
Polarizability: 125.6±0.5 10-24cm3
Surface Tension: 83.6±5.0 dyne/cm
Molar Volume: 870.8±5.0 cm3

Click to predict properties on the Chemicalize site


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