ChemSpider 2D Image | (1S,3S)-3-Ethyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-(4-morpholinyl)-alpha-D-lyxo-hexopyranoside | C30H35NO10

(1S,3S)-3-Ethyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-(4-morpholinyl)-α-D-lyxo-hexopyranoside

  • Molecular FormulaC30H35NO10
  • Average mass569.600 Da
  • Monoisotopic mass569.226074 Da
  • ChemSpider ID8183759

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(1S,3S)-3-Ethyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl 2,3,6-trideoxy-3-(4-morpholinyl)-α-D-lyxo-hexopyranoside [ACD/IUPAC Name]
(1S,3S)-3-Ethyl-3,5,10,12-tetrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tetracenyl-2,3,6-tridesoxy-3-(4-morpholinyl)-α-D-lyxo-hexopyranosid [German] [ACD/IUPAC Name]
2,3,6-Tridésoxy-3-(4-morpholinyl)-α-D-lyxo-hexopyranoside de (1S,3S)-3-éthyl-3,5,10,12-tétrahydroxy-6,11-dioxo-1,2,3,4,6,11-hexahydro-1-tétracényle [French] [ACD/IUPAC Name]
5,12-Naphthacenedione, 8-ethyl-7,8,9,10-tetrahydro-1,6,8,11-tetrahydroxy-10-[[2,3,6-trideoxy-3-(4-morpholinyl)-α-D-lyxo-hexopyranosyl]oxy]-, (8S,10S)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 753.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 115.2±3.0 kJ/mol
Flash Point: 409.2±32.9 °C
Index of Refraction: 1.698
Molar Refractivity: 143.5±0.4 cm3
#H bond acceptors: 11
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 4
ACD/LogP: 6.76
ACD/LogD (pH 5.5): 3.63
ACD/BCF (pH 5.5): 203.08
ACD/KOC (pH 5.5): 859.57
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 81.79
ACD/KOC (pH 7.4): 346.20
Polar Surface Area: 166 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 87.2±5.0 dyne/cm
Molar Volume: 372.1±5.0 cm3

Click to predict properties on the Chemicalize site


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