ChemSpider 2D Image | (1R,3S)-3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl beta-D-ribofuranoside | C26H26O13

(1R,3S)-3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl β-D-ribofuranoside

  • Molecular FormulaC26H26O13
  • Average mass546.477 Da
  • Monoisotopic mass546.137329 Da
  • ChemSpider ID114311

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1R,3S)-3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl β-D-ribofuranoside [ACD/IUPAC Name]
(1R,3S)-3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-β-D-ribofuranosid [German] [ACD/IUPAC Name]
5,12-Naphthacenedione, 7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-10-(β-D-ribofuranosyloxy)-, (8S,10R)- [ACD/Index Name]
β-D-Ribofuranoside de (1R,3S)-3,5,12-trihydroxy-3-(2-hydroxyacétyl)-10-méthoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
105444-10-8 [RN]
7-O-(D-Ribofuranosyl)adriamycinone
7-O-Rfadm
7-O-Ribofuranosyladriamycinone

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

Density: 1.8±0.1 g/cm3
Boiling Point: 869.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 132.3±3.0 kJ/mol
Flash Point: 293.9±27.8 °C
Index of Refraction: 1.745
Molar Refractivity: 126.3±0.4 cm3
#H bond acceptors: 13
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.81
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 3.50
ACD/KOC (pH 5.5): 84.64
ACD/LogD (pH 7.4): 0.53
ACD/BCF (pH 7.4): 1.12
ACD/KOC (pH 7.4): 27.03
Polar Surface Area: 221 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 114.5±5.0 dyne/cm
Molar Volume: 311.6±5.0 cm3

Click to predict properties on the Chemicalize site


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