ChemSpider 2D Image | 3-Amino-N-(5-amino-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-2-{[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy}-3-hydroxycyclohexyl)-2-hydroxypropanamide | C22H43N5O12

3-Amino-N-(5-amino-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-2-{[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy}-3-hydroxycyclohexyl)-2-hydroxypropanamide

  • Molecular FormulaC22H43N5O12
  • Average mass569.603 Da
  • Monoisotopic mass569.290833 Da
  • ChemSpider ID3624

More details:

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

3-Amino-N-(5-amino-4-[(6-amino-6-deoxyhexopyranosyl)oxy]-2-{[3-deoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy}-3-hydroxycyclohexyl)-2-hydroxypropanamide [ACD/IUPAC Name]
3-Amino-N-(5-amino-4-[(6-amino-6-desoxyhexopyranosyl)oxy]-2-{[3-desoxy-4-C-methyl-3-(methylamino)pentopyranosyl]oxy}-3-hydroxycyclohexyl)-2-hydroxypropanamid [German] [ACD/IUPAC Name]
3-Amino-N-(5-amino-4-[(6-amino-6-désoxyhexopyranosyl)oxy]-2-{[3-désoxy-4-C-méthyl-3-(méthylamino)pentopyranosyl]oxy}-3-hydroxycyclohexyl)-2-hydroxypropanamide [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- [ACD/Index Name]
3-Amino-N-[5-amino-4-(6-aminomethyl-3,4,5-trihydroxy-tetrahydro-pyran-2-yloxy)-2-(3,5-dihydroxy-5-methyl-4-methylamino-tetrahydro-pyran-2-yloxy)-3-hydroxy-cyclohexyl]-2-hydroxy-propionamide
Isepamicine

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

BRN 4896716 [DBID]
CCRIS 1919 [DBID]
Sch 21420 [DBID]
Sch-21420 [DBID]

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

Density: 1.5±0.1 g/cm3
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: 1.641
Molar Refractivity: 133.5±0.4 cm3
#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: 298 Å2
Polarizability: 52.9±0.5 10-24cm3
Surface Tension: 90.9±5.0 dyne/cm
Molar Volume: 369.9±5.0 cm3

Click to predict properties on the Chemicalize site


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