ChemSpider 2D Image | 3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 6-deoxy-2-O-methylhexopyranoside | C28H30O13

3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 6-deoxy-2-O-methylhexopyranoside

  • Molecular FormulaC28H30O13
  • Average mass574.530 Da
  • Monoisotopic mass574.168640 Da
  • ChemSpider ID2339257

More details:

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

3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 6-deoxy-2-O-methylhexopyranoside [ACD/IUPAC Name]
3-Glycoloyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-6-desoxy-2-O-methylhexopyranosid [German] [ACD/IUPAC Name]
5,12-Naphthacenedione, 10-[(6-deoxy-2-O-methylhexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy- [ACD/Index Name]
6-Désoxy-2-O-méthylhexopyranoside de 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]
124209-63-8 [RN]
7(O)-(6-Deoxy-2-O-methyltalopyranosyl)adriamycinone
7-Dmta

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

Density: 1.6±0.1 g/cm3
Boiling Point: 826.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 125.9±3.0 kJ/mol
Flash Point: 273.8±27.8 °C
Index of Refraction: 1.696
Molar Refractivity: 135.8±0.4 cm3
#H bond acceptors: 13
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 17.79
ACD/KOC (pH 5.5): 271.19
ACD/LogD (pH 7.4): 1.46
ACD/BCF (pH 7.4): 5.72
ACD/KOC (pH 7.4): 87.24
Polar Surface Area: 210 Å2
Polarizability: 53.8±0.5 10-24cm3
Surface Tension: 94.5±5.0 dyne/cm
Molar Volume: 353.0±5.0 cm3

Click to predict properties on the Chemicalize site


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