ChemSpider 2D Image | alpha-Aspartyl-N-[(24E)-1,19-dihydroxy-12-(1-hydroxyethyl)-30-(1-hydroxy-2-methylpropyl)-27-[1-(1H-indol-3-yl)ethyl]-24-(1H-indol-3-ylmethylene)-9,16-dimethyl-5,8,11,14,18,23,26,29,32-nonaoxotriaconta hydro-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]serinamide | C59H77N13O19

α-Aspartyl-N-[(24E)-1,19-dihydroxy-12-(1-hydroxyethyl)-30-(1-hydroxy-2-methylpropyl)-27-[1-(1H-indol-3-yl)ethyl]-24-(1H-indol-3-ylmethylene)-9,16-dimethyl-5,8,11,14,18,23,26,29,32-nonaoxotriaconta hydro-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]serinamide

  • Molecular FormulaC59H77N13O19
  • Average mass1272.318 Da
  • Monoisotopic mass1271.545898 Da
  • ChemSpider ID78444436

  • Double-bond stereo - Double-bond stereo

More details:

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

Serinamide, α-aspartyl-N-[(24E)-triacontahydro-1,19-dihydroxy-12-(1-hydroxyethyl)-30-(1-hydroxy-2-methylpropyl)-27-[1-(1H-indol-3-yl)ethyl]-24-(1H-indol-3-ylmethylene)-9,16-dimethyl-5,8,11,14,18,2 3,26,29,32-nonaoxo-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]- [ACD/Index Name]
α-Asparagyl-N-[(24E)-1,19-dihydroxy-12-(1-hydroxyethyl)-30-(1-hydroxy-2-methylpropyl)-27-[1-(1H-indol-3-yl)ethyl]-24-(1H-indol-3-ylmethylen)-9,16-dimethyl-5,8,11,14,18,23,26,29,32-nonaoxotriaconta hydro-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]serinamid [German] [ACD/IUPAC Name]
α-Aspartyl-N-[(24E)-1,19-dihydroxy-12-(1-hydroxyethyl)-30-(1-hydroxy-2-methylpropyl)-27-[1-(1H-indol-3-yl)ethyl]-24-(1H-indol-3-ylmethylene)-9,16-dimethyl-5,8,11,14,18,23,26,29,32-nonaoxotriaconta hydro-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]serinamide [ACD/IUPAC Name]
α-Aspartyl-N-[(24E)-1,19-dihydroxy-12-(1-hydroxyéthyl)-30-(1-hydroxy-2-méthylpropyl)-27-[1-(1H-indol-3-yl)éthyl]-24-(1H-indol-3-ylméthylène)-9,16-diméthyl-5,8,11,14,18,23,26,29,32-nonaoxotriaconta hydro-18H-dipyrrolo[2,1-c:2',1'-o][1,4,7,10,13,16,19,22,25]oxaoctaazacyclooctacosin-15-yl]sérinamide [French] [ACD/IUPAC Name]
Ambobactin

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

Density: 1.5±0.1 g/cm3
Boiling Point: 1777.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 299.0±3.0 kJ/mol
Flash Point: 1028.5±34.3 °C
Index of Refraction: 1.690
Molar Refractivity: 319.7±0.4 cm3
#H bond acceptors: 32
#H bond donors: 18
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -5.97
ACD/LogD (pH 5.5): -8.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 496 Å2
Polarizability: 126.7±0.5 10-24cm3
Surface Tension: 91.7±5.0 dyne/cm
Molar Volume: 836.5±5.0 cm3

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