ChemSpider 2D Image | Kanamycin B | C18H37N5O10

Kanamycin B

  • Molecular FormulaC18H37N5O10
  • Average mass483.514 Da
  • Monoisotopic mass483.254028 Da
  • ChemSpider ID27471520
  • defined stereocentres - 15 of 15 defined stereocentres


More details:






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

(1S,2R,3R,4S,6R)-4,6-Diamino-3-[(3-amino-3-deoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy-α-D-glucopyranoside [ACD/IUPAC Name]
(1S,2R,3R,4S,6R)-4,6-Diamino-3-[(3-amino-3-desoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl-2,6-diamino-2,6-didesoxy-α-D-glucopyranosid [German] [ACD/IUPAC Name]
2,6-Diamino-2,6-didésoxy-α-D-glucopyranoside de (1S,2R,3R,4S,6R)-4,6-diamino-3-[(3-amino-3-désoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyle [French] [ACD/IUPAC Name]
4696-76-8 [RN]
Kanamycin B
α-D-Glucopyranoside, (1S,2R,3R,4S,6R)-4,6-diamino-3-[(3-amino-3-deoxy-α-D-glucopyranosyl)oxy]-2-hydroxycyclohexyl 2,6-diamino-2,6-dideoxy- [ACD/Index Name]
(2R,3S,4R,5R,6R)-5-Amino-2-(aminomethyl)-6-[(1R,2S,3S,4R,6S)-4, 6-diamino-3-[(2S,3R,4S,5S,6R)-4-amino-3,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2-hydroxycyclohexyl]oxyoxane-3,4-diol
[4696-76-8]
225-170-5 [EINECS]
29701-07-3 (·H2SO4)
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 807.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.5 mmHg at 25°C
Enthalpy of Vaporization: 133.7±6.0 kJ/mol
Flash Point: 442.3±34.3 °C
Index of Refraction: 1.668
Molar Refractivity: 113.2±0.4 cm3
#H bond acceptors: 15
#H bond donors: 16
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -2.93
ACD/LogD (pH 5.5): -10.97
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 288 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 101.5±5.0 dyne/cm
Molar Volume: 303.8±5.0 cm3

Click to predict properties on the Chemicalize site






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