ChemSpider 2D Image | 3-[5,8-bis(2-amino-2-oxo-ethyl)-17,20-bis(1-hydroxyethyl)-23-(3-hydroxytetradecyl)-2-(8-hydroxytetradecyl)-11-methyl-3,6,9,12,15,18,21,24,27,31-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclohentriacont-14-yl]-2-hydroxy-propanamide | C61H109N13O18

3-[5,8-bis(2-amino-2-oxo-ethyl)-17,20-bis(1-hydroxyethyl)-23-(3-hydroxytetradecyl)-2-(8-hydroxytetradecyl)-11-methyl-3,6,9,12,15,18,21,24,27,31-decaoxo-1,4,7,10,13,16,19,22,25,28-decazacyclohentriacont-14-yl]-2-hydroxy-propanamide

  • Molecular FormulaC61H109N13O18
  • Average mass1312.594 Da
  • Monoisotopic mass1311.801392 Da
  • ChemSpider ID8052753

More details:

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

3-[5,8-Bis(2-amino-2-oxoethyl)-17,20-bis(1-hydroxyethyl)-23-(3-hydroxytetradecyl)-2-(8-hydroxytetradecyl)-11-methyl-3,6,9,12,15,18,21,24,27,31-decaoxo-1,4,7,10,13,16,19,22,25,28-decaazacyclohentriacon tan-14-yl]-2-hydroxypropanamid [German] [ACD/IUPAC Name]
3-[5,8-Bis(2-amino-2-oxoéthyl)-17,20-bis(1-hydroxyéthyl)-23-(3-hydroxytétradécyl)-2-(8-hydroxytétradécyl)-11-méthyl-3,6,9,12,15,18,21,24,27,31-décaoxo-1,4,7,10,13,16,19,22,25,28-décaazacyclohéntriacon tan-14-yl]-2-hydroxypropanamide [French] [ACD/IUPAC Name]
Arborcandin F

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

Density: 1.1±0.1 g/cm3
Boiling Point: 1665.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 294.3±6.0 kJ/mol
Flash Point: 960.8±34.3 °C
Index of Refraction: 1.491
Molar Refractivity: 335.5±0.3 cm3
#H bond acceptors: 31
#H bond donors: 21
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 3
ACD/LogP: -3.31
ACD/LogD (pH 5.5): -2.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 521 Å2
Polarizability: 133.0±0.5 10-24cm3
Surface Tension: 41.7±3.0 dyne/cm
Molar Volume: 1158.0±3.0 cm3

Click to predict properties on the Chemicalize site


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