ChemSpider 2D Image | Desoxymycin | C21H41N7O11

Desoxymycin

  • Molecular FormulaC21H41N7O11
  • Average mass567.591 Da
  • Monoisotopic mass567.286377 Da
  • ChemSpider ID10128124

  • defined stereocentres - 15 of 15 defined stereocentres

More details:

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

1,1'-[(1R,2R,3S,4R,5R,6S)-4-({3,5-Dideoxy-2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-(hydroxymethyl)-α-L-arabinofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexanediyl]diguanidine [ACD/IUPAC Name]
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({3,5-Dideoxy-2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-(hydroxymethyl)-α-L-arabinofuranosyl}oxy)-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({3,5-Didesoxy-2-O-[2-desoxy-2-(methylamino)-α-L-glucopyranosyl]-3-(hydroxymethyl)-α-L-arabinofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexandiyl]diguanidin [German] [ACD/IUPAC Name]
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({3,5-Didésoxy-2-O-[2-désoxy-2-(méthylamino)-α-L-glucopyranosyl]-3-(hydroxyméthyl)-α-L-arabinofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexanediyl]diguanidine [French] [ACD/IUPAC Name]
26086-49-7 [RN]
deoxydihydrostreptomycin
Desoxymycin
Dihydrodeoxystreptomycin
Guanidine, N,N'''-[(1R,2R,3S,4R,5R,6S)-4-[[3,5-dideoxy-2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-(hydroxymethyl)-α-L-arabinofuranosyl]oxy]-2,5,6-trihydroxy-1,3-cyclohexanediyl]bis- [ACD/Index Name]
Mervastrept
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

6B6534650A [DBID]
C03755 [DBID]
UNII:6B6534650A [DBID]
UNII-6B6534650A [DBID]

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

Density: 2.0±0.1 g/cm3
Boiling Point: 835.2±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 138.1±6.0 kJ/mol
Flash Point: 458.9±37.1 °C
Index of Refraction: 1.760
Molar Refractivity: 119.7±0.5 cm3
#H bond acceptors: 18
#H bond donors: 16
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: -3.85
ACD/LogD (pH 5.5): -9.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -8.06
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 314 Å2
Polarizability: 47.4±0.5 10-24cm3
Surface Tension: 87.6±7.0 dyne/cm
Molar Volume: 290.9±7.0 cm3

Click to predict properties on the Chemicalize site


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