ChemSpider 2D Image | 6-Ammonio-4-[(3-ammonio-2-hydroxypropanoyl)amino]-3-{[3-deoxy-4-C-methyl-3-(methylammonio)pentopyranosyl]oxy}-2-hydroxycyclohexyl 6-ammonio-6-deoxyhexopyranoside | C22H47N5O12

6-Ammonio-4-[(3-ammonio-2-hydroxypropanoyl)amino]-3-{[3-deoxy-4-C-methyl-3-(methylammonio)pentopyranosyl]oxy}-2-hydroxycyclohexyl 6-ammonio-6-deoxyhexopyranoside

  • Molecular FormulaC22H47N5O12
  • Average mass573.633 Da
  • Monoisotopic mass573.319946 Da
  • ChemSpider ID21432870

  • Charge - Charge

More details:

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

6-Ammonio-4-[(3-ammonio-2-hydroxypropanoyl)amino]-3-{[3-deoxy-4-C-methyl-3-(methylammonio)pentopyranosyl]oxy}-2-hydroxycyclohexyl 6-ammonio-6-deoxyhexopyranoside [ACD/IUPAC Name]
6-Ammonio-4-[(3-ammonio-2-hydroxypropanoyl)amino]-3-{[3-desoxy-4-C-methyl-3-(methylammonio)pentopyranosyl]oxy}-2-hydroxycyclohexyl-6-ammonio-6-desoxyhexopyranosid [German] [ACD/IUPAC Name]
6-Ammonio-6-désoxyhexopyranoside de 6-ammonio-4-[(3-ammonio-2-hydroxypropanoyl)amino]-3-{[3-désoxy-4-C-méthyl-3-(méthylammonio)pentopyranosyl]oxy}-2-hydroxycyclohexyle [French] [ACD/IUPAC Name]
Propanamide, 3-amino-N-[5-amino-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-2-[[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy]-3-hydroxycyclohexyl]-2-hydroxy-, conjugate tetraacid [ACD/Index Name]

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

Density:
Boiling Point: 926.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 153.0±6.0 kJ/mol
Flash Point: 514.3±34.3 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 17
#H bond donors: 15
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 3
ACD/LogP: -2.45
ACD/LogD (pH 5.5): -9.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.08
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 307 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


Advertisement