ChemSpider 2D Image | CSID:17288121 | C66H73Cl2N9O24

  • Molecular FormulaC66H73Cl2N9O24
  • Average mass1447.238 Da
  • Monoisotopic mass1445.414551 Da
  • ChemSpider ID17288121

More details:






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

22-(2-Amino-2-oxoethyl)-2-[(3-amino-2,3,6-tridesoxy-3-methylhexopyranosyl-4-ulose)oxy]-5,15-dichlor-48-(hexopyranosyloxy)-18,32,35,37-tetrahydroxy-19-[(N-methylleucyl)amino]-20,23,26,42,44-pentaoxo-7, ;13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadecaen-40-carbonsäure [German] [ACD/IUPAC Name]
Acide 22-(2-amino-2-oxoéthyl)-2-[(3-amino-2,3,6-tridésoxy-3-méthylhexopyranosyl-4-ulose)oxy]-5,15-dichloro-48-(hexopyranosyloxy)-18,32,35,37-tétrahydroxy-19-[(N-méthylleucyl)amino]-20,23,26,42,44-pent ;aoxo-7,13-dioxa-21,24,27,41,43-pentaazaoctacyclo[26.14.2.23,6.214,17.18,12.129,33.010,25.034,39]pentaconta-3,5,8(48),9,11,14,16,29(45),30,32,34,36,38,46,49-pentadécaène-40-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.732
Molar Refractivity: 349.4±0.4 cm3
#H bond acceptors: 33
#H bond donors: 20
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: -1.14
ACD/LogD (pH 5.5): -5.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 527 Å2
Polarizability: 138.5±0.5 10-24cm3
Surface Tension: 104.2±5.0 dyne/cm
Molar Volume: 873.6±5.0 cm3

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