ChemSpider 2D Image | N-(3-Hydroxydecanoyl)leucyl-alpha-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N~1~-[3-sec-butyl-6-(hydroxymethyl)-9-isobutyl-12-isopropyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetraazacyclohexad ecan-15-yl]glutamamide | C81H141N17O23

N-(3-Hydroxydecanoyl)leucyl-α-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N1-[3-sec-butyl-6-(hydroxymethyl)-9-isobutyl-12-isopropyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetraazacyclohexad ecan-15-yl]glutamamide

  • Molecular FormulaC81H141N17O23
  • Average mass1721.086 Da
  • Monoisotopic mass1720.038574 Da
  • ChemSpider ID78444898

More details:

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

Glutamamide, N-(3-hydroxy-1-oxodecyl)leucyl-α-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N1-[6-(hydroxymethyl)-12-(1-methylethyl)-3-(1-methylpropyl)-9-(2-methylpropyl)-2,5,8,11,14-pentao xo-1-oxa-4,7,10,13-tetraazacyclohexadec-15-yl]- [ACD/Index Name]
N-(3-Hydroxydecanoyl)leucyl-α-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N1-[3-sec-butyl-6-(hydroxymethyl)-9-isobutyl-12-isopropyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetraazacyclohexad
 ecan-15-yl]glutamamid [German] [ACD/IUPAC Name]
N-(3-Hydroxydecanoyl)leucyl-α-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N1-[3-sec-butyl-6-(hydroxymethyl)-9-isobutyl-12-isopropyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tetraazacyclohexad
 ecan-15-yl]glutamamide [ACD/IUPAC Name]
N-(3-Hydroxydecanoyl)leucyl-α-glutamylglutaminylvalylleucylglutaminylvalylleucyl-N1-[3-sec-butyl-6-(hydroxyméthyl)-9-isobutyl-12-isopropyl-2,5,8,11,14-pentaoxo-1-oxa-4,7,10,13-tétraazacyclohexad
 écan-15-yl]glutamamide [French] [ACD/IUPAC Name]
Entolysin A

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

Density: 1.3±0.1 g/cm3
Boiling Point: 1906.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 348.8±6.0 kJ/mol
Flash Point: 1106.7±34.3 °C
Index of Refraction: 1.562
Molar Refractivity: 445.1±0.4 cm3
#H bond acceptors: 40
#H bond donors: 23
#Freely Rotating Bonds: 53
#Rule of 5 Violations: 3
ACD/LogP: 1.62
ACD/LogD (pH 5.5): -1.48
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.18
ACD/LogD (pH 7.4): -3.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 641 Å2
Polarizability: 176.5±0.5 10-24cm3
Surface Tension: 62.1±5.0 dyne/cm
Molar Volume: 1372.8±5.0 cm3

Click to predict properties on the Chemicalize site


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