ChemSpider 2D Image | 3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside | C28H31NO11

3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside

  • Molecular FormulaC28H31NO11
  • Average mass557.546 Da
  • Monoisotopic mass557.189697 Da
  • ChemSpider ID380676

More details:

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

3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-naphthacenyl 3-amino-2,3,6-trideoxyhexopyranoside
3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 3-amino-2,3,6-trideoxyhexopyranoside [ACD/IUPAC Name]
3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-3-amino-2,3,6-tridesoxyhexopyranosid [German] [ACD/IUPAC Name]
3-Amino-2,3,6-tridésoxyhexopyranoside de 3,5,12-trihydroxy-10-méthoxy-3-(2-méthoxyacétyl)-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione, 10-[(3-amino-2,3,6-trideoxyhexopyranosyl)oxy]-7,8,9,10-tetrahydro-6,8,11-trihydroxy-1-methoxy-8-(2-methoxyacetyl)- [ACD/Index Name]
66678-33-9 [RN]

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

AIDS128439 [DBID]
AIDS-128439 [DBID]
NSC 275647 [DBID]
NSC275647 [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: 803.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.4±3.0 kJ/mol
Flash Point: 439.5±34.3 °C
Index of Refraction: 1.679
Molar Refractivity: 136.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 3
ACD/LogP: 2.90
ACD/LogD (pH 5.5): -1.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.99
Polar Surface Area: 195 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 85.3±5.0 dyne/cm
Molar Volume: 361.4±5.0 cm3

Click to predict properties on the Chemicalize site


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