ChemSpider 2D Image | Galmic | C51H60N10O11

Galmic

  • Molecular FormulaC51H60N10O11
  • Average mass989.083 Da
  • Monoisotopic mass988.444275 Da
  • ChemSpider ID25046661
  • defined stereocentres - 4 of 4 defined stereocentres


More details:






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

Galmic [Wiki]
L-Lysine, N2-[[(4R,11R,18R)-11-[[(cyclohexylmethyl)amino]carbonyl]-18-[(9H-fluoren-9-ylamino)carbonyl]-4,7,11,14,18,21-hexamethyl-2,9,16-trioxo-6,13,20-trioxa-3,10,17,22,23,24-hexaazatetracyclo[17.2 .1.15,8.112,15]tetracosa-5(24),7,12(23),14,19(22),21-hexaen-4-yl]carbonyl]-, methyl ester [ACD/Index Name]
Methyl N2-{[(4R,11R,18R)-11-[(cyclohexylmethyl)carbamoyl]-18-(9H-fluoren-9-ylcarbamoyl)-4,7,11,14,18,21-hexamethyl-2,9,16-trioxo-6,13,20-trioxa-3,10,17,22,23,24-hexaazatetracyclo[17.2.1.15,8.112, 15]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaen-4-yl]carbonyl}-L-lysinate [ACD/IUPAC Name]
Methyl-N2-{[(4R,11R,18R)-11-[(cyclohexylmethyl)carbamoyl]-18-(9H-fluoren-9-ylcarbamoyl)-4,7,11,14,18,21-hexamethyl-2,9,16-trioxo-6,13,20-trioxa-3,10,17,22,23,24-hexaazatetracyclo[17.2.1.15,8.112, 15]tetracosa-1(21),5(24),7,12(23),14,19(22)-hexaen-4-yl]carbonyl}-L-lysinat [German] [ACD/IUPAC Name]
N2-{[(4R,11R,18R)-11-[(Cyclohexylméthyl)carbamoyl]-18-(9H-fluorén-9-ylcarbamoyl)-4,7,11,14,18,21-hexaméthyl-2,9,16-trioxo-6,13,20-trioxa-3,10,17,22,23,24-hexaazatétracyclo[17.2.1.15,8.112,15]tét racosa-1(21),5(24),7,12(23),14,19(22)-hexaén-4-yl]carbonyl}-L-lysinate de méthyle [French] [ACD/IUPAC Name]
10.1021/jm9018349

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

Density: 1.4±0.1 g/cm3
Boiling Point: 1289.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 194.1±3.0 kJ/mol
Flash Point: 733.5±34.3 °C
Index of Refraction: 1.646
Molar Refractivity: 257.2±0.4 cm3
#H bond acceptors: 21
#H bond donors: 8
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 2.22
ACD/LogD (pH 5.5): -0.70
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 305 Å2
Polarizability: 102.0±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 708.6±5.0 cm3

Click to predict properties on the Chemicalize site





Feedback Form