ChemSpider 2D Image | (3S)-6-Hydroxy-3-methyl-1,7,12-trioxo-1,2,3,4,7,12-hexahydro-8-tetraphenyl 6-deoxy-alpha-L-glucopyranoside | C25H24O9

(3S)-6-Hydroxy-3-methyl-1,7,12-trioxo-1,2,3,4,7,12-hexahydro-8-tetraphenyl 6-deoxy-α-L-glucopyranoside

  • Molecular FormulaC25H24O9
  • Average mass468.453 Da
  • Monoisotopic mass468.142029 Da
  • ChemSpider ID78442919

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(3S)-6-Hydroxy-3-methyl-1,7,12-trioxo-1,2,3,4,7,12-hexahydro-8-tetraphenyl 6-deoxy-α-L-glucopyranoside [ACD/IUPAC Name]
(3S)-6-Hydroxy-3-methyl-1,7,12-trioxo-1,2,3,4,7,12-hexahydro-8-tetraphenyl-6-desoxy-α-L-glucopyranosid [German] [ACD/IUPAC Name]
6-Désoxy-α-L-glucopyranoside de (3S)-6-hydroxy-3-méthyl-1,7,12-trioxo-1,2,3,4,7,12-hexahydro-8-tétraphényle [French] [ACD/IUPAC Name]
Benz[a]anthracene-1,7,12(2H)-trione, 8-[(6-deoxy-α-L-glucopyranosyl)oxy]-3,4-dihydro-6-hydroxy-3-methyl-, (3S)- [ACD/Index Name]
Atramycin A

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

Density: 1.5±0.1 g/cm3
Boiling Point: 793.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.0±3.0 kJ/mol
Flash Point: 274.8±26.4 °C
Index of Refraction: 1.676
Molar Refractivity: 116.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 22.85
ACD/KOC (pH 5.5): 214.51
ACD/LogD (pH 7.4): 0.58
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.14
Polar Surface Area: 151 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 75.3±3.0 dyne/cm
Molar Volume: 309.3±3.0 cm3

Click to predict properties on the Chemicalize site


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