ChemSpider 2D Image | Reticulin | C21H39N7O13

Reticulin

  • Molecular FormulaC21H39N7O13
  • Average mass597.573 Da
  • Monoisotopic mass597.260559 Da
  • ChemSpider ID21759

  • 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-({2-O-[2-Deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-C-formyl-α-L-lyxofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexanediyl]diguanidine [ACD/IUPAC Name]
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({2-O-[2-Deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-C-formyl-α-L-lyxofuranosyl}oxy)-2,5,6-trihydroxycyclohexane-1,3-diyl]diguanidine
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({2-O-[2-Desoxy-2-(methylamino)-α-L-glucopyranosyl]-3-C-formyl-α-L-lyxofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexandiyl]diguanidin [German] [ACD/IUPAC Name]
1,1'-[(1R,2R,3S,4R,5R,6S)-4-({2-O-[2-Désoxy-2-(méthylamino)-α-L-glucopyranosyl]-3-C-formyl-α-L-lyxofuranosyl}oxy)-2,5,6-trihydroxy-1,3-cyclohexanediyl]diguanidine [French] [ACD/IUPAC Name]
5'-hydroxystreptomycin
6835-00-3 [RN]
Guanidine, N,N'''-[(1R,2R,3S,4R,5R,6S)-4-[[2-O-[2-deoxy-2-(methylamino)-α-L-glucopyranosyl]-3-C-formyl-α-L-lyxofuranosyl]oxy]-2,5,6-trihydroxy-1,3-cyclohexanediyl]bis- [ACD/Index Name]
hydroxystreptomycin
QXR888I04O
Reticulin [Wiki]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 2.0±0.1 g/cm3
Boiling Point: 918.7±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 151.6±6.0 kJ/mol
Flash Point: 509.4±37.1 °C
Index of Refraction: 1.778
Molar Refractivity: 122.1±0.5 cm3
#H bond acceptors: 20
#H bond donors: 17
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 3
ACD/LogP: -2.81
ACD/LogD (pH 5.5): -8.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -7.73
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 352 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 100.8±7.0 dyne/cm
Molar Volume: 291.6±7.0 cm3

Click to predict properties on the Chemicalize site


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