ChemSpider 2D Image | 2'-oxokanamycin | C18H34N4O11

2'-oxokanamycin

  • Molecular FormulaC18H34N4O11
  • Average mass482.483 Da
  • Monoisotopic mass482.222412 Da
  • ChemSpider ID28639116

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

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

(1R,2R,3S,4R,6S)-4,6-Diamino-3-[(3-amino-3-deoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl 6-amino-6-deoxy-α-D-arabino-hexopyranosid-2-ulose [ACD/IUPAC Name]
(1R,2R,3S,4R,6S)-4,6-Diamino-3-[(3-amino-3-desoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl-6-amino-6-desoxy-α-D-arabino-hexopyranosid-2-ulose [German] [ACD/IUPAC Name]
2'-oxokanamycin
6-Amino-6-désoxy-α-D-arabino-hexopyranosid-2-ulose de (1R,2R,3S,4R,6S)-4,6-diamino-3-[(3-amino-3-désoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyle [French] [ACD/IUPAC Name]
α-D-arabino-Hexopyranosid-2-ulose, (1R,2R,3S,4R,6S)-4,6-diamino-3-[(3-amino-3-deoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl 6-amino-6-deoxy- [ACD/Index Name]
2'-dehydrokanamycin A
2'-ketokanamycin

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

Density: 1.6±0.1 g/cm3
Boiling Point: 824.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 136.4±6.0 kJ/mol
Flash Point: 452.4±34.3 °C
Index of Refraction: 1.662
Molar Refractivity: 109.7±0.4 cm3
#H bond acceptors: 15
#H bond donors: 14
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -1.98
ACD/LogD (pH 5.5): -9.00
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 279 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 101.7±5.0 dyne/cm
Molar Volume: 296.5±5.0 cm3

Click to predict properties on the Chemicalize site


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