ChemSpider 2D Image | 3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-[(methoxycarbonyl)amino]hexopyranoside | C29H31NO12

3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-[(methoxycarbonyl)amino]hexopyranoside

  • Molecular FormulaC29H31NO12
  • Average mass585.556 Da
  • Monoisotopic mass585.184631 Da
  • ChemSpider ID75675

More details:

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

2,3,6-Tridésoxy-3-[(méthoxycarbonyl)amino]hexopyranoside de 3-acétyl-3,5,12-trihydroxy-10-méthoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-[(methoxycarbonyl)amino]hexopyranoside [ACD/IUPAC Name]
3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-2,3,6-tridesoxy-3-[(methoxycarbonyl)amino]hexopyranosid [German] [ACD/IUPAC Name]
5,12-Naphthacenedione, 8-acetyl-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-10-[[2,3,6-trideoxy-3-[(methoxycarbonyl)amino]hexopyranosyl]oxy]- [ACD/Index Name]
38942-79-9 [RN]
Daunomycin, N-carbmethoxy-
Daunomycin, N-carboxy-, methyl ester
Daunorubicin, N-carbmethoxy-
Rubomycin H

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

NSC143113 [DBID]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 824.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.6±3.0 kJ/mol
Flash Point: 452.3±34.3 °C
Index of Refraction: 1.669
Molar Refractivity: 141.1±0.4 cm3
#H bond acceptors: 13
#H bond donors: 5
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 32.71
ACD/KOC (pH 5.5): 419.66
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 11.04
ACD/KOC (pH 7.4): 141.67
Polar Surface Area: 198 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 83.2±5.0 dyne/cm
Molar Volume: 378.2±5.0 cm3

Click to predict properties on the Chemicalize site


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