ChemSpider 2D Image | 3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-4-O-{3-hydroxy-1-[(1-hydroxy-2-propanyl)oxy]butyl}hexopyranoside | C34H43NO13

3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-4-O-{3-hydroxy-1-[(1-hydroxy-2-propanyl)oxy]butyl}hexopyranoside

  • Molecular FormulaC34H43NO13
  • Average mass673.704 Da
  • Monoisotopic mass673.273438 Da
  • ChemSpider ID134396

More details:

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

3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxy-4-O-{3-hydroxy-1-[(1-hydroxy-2-propanyl)oxy]butyl}hexopyranoside [ACD/IUPAC Name]
3-Acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-3-amino-2,3,6-tridesoxy-4-O-{3-hydroxy-1-[(1-hydroxy-2-propanyl)oxy]butyl}hexopyranosid [German] [ACD/IUPAC Name]
3-Amino-2,3,6-tridésoxy-4-O-{3-hydroxy-1-[(1-hydroxy-2-propanyl)oxy]butyl}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]
5,12-Naphthacenedione, 8-acetyl-10-[[3-amino-2,3,6-trideoxy-4-O-[3-hydroxy-1-(2-hydroxy-1-methylethoxy)butyl]hexopyranosyl]oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy- [ACD/Index Name]
64253-71-0 [RN]
Baumycin A2

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

Density: 1.5±0.1 g/cm3
Boiling Point: 897.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 136.7±3.0 kJ/mol
Flash Point: 496.5±34.3 °C
Index of Refraction: 1.643
Molar Refractivity: 167.4±0.4 cm3
#H bond acceptors: 14
#H bond donors: 7
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 3
ACD/LogP: 3.98
ACD/LogD (pH 5.5): -0.53
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.66
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.07
Polar Surface Area: 225 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 77.0±5.0 dyne/cm
Molar Volume: 462.5±5.0 cm3

Click to predict properties on the Chemicalize site


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