Found 19 results

Search term: MF = 'C_{26}H_{38}O_{11}'
ChemSpider 2D Image | Methyl (1R,3S,4aR,4bS,6R,8aR,10aR)-3-acetoxy-6-[(2S,3R,4S,5R)-3,4-dihydroxy-2,5-dimethoxytetrahydro-3-furanyl]-4b,10a-dimethyl-4,8-dioxotetradecahydro-1-phenanthrenecarboxylate | C26H38O11

Methyl (1R,3S,4aR,4bS,6R,8aR,10aR)-3-acetoxy-6-[(2S,3R,4S,5R)-3,4-dihydroxy-2,5-dimethoxytetrahydro-3-furanyl]-4b,10a-dimethyl-4,8-dioxotetradecahydro-1-phenanthrenecarboxylate

  • Molecular FormulaC26H38O11
  • Average mass526.573 Da
  • Monoisotopic mass526.241394 Da
  • ChemSpider ID28942452

  • defined stereocentres - 11 of 11 defined stereocentres

More details:

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

(1R,3S,4aR,4bS,6R,8aR,10aR)-3-Acétoxy-6-[(2S,3R,4S,5R)-3,4-dihydroxy-2,5-diméthoxytétrahydro-3-furanyl]-4b,10a-diméthyl-4,8-dioxotétradécahydro-1-phénanthrènecarboxylate de méthyle [French] [ACD/IUPAC Name]
1-Phenanthrenecarboxylic acid, 3-(acetyloxy)tetradecahydro-4b,10a-dimethyl-4,8-dioxo-6-[(2S,3R,4S,5R)-tetrahydro-3,4-dihydroxy-2,5-dimethoxy-3-furanyl]-, methyl ester, (1R,3S,4aR,4bS,6R,8aR,10aR)- [ACD/Index Name]
Methyl (1R,3S,4aR,4bS,6R,8aR,10aR)-3-acetoxy-6-[(2S,3R,4S,5R)-3,4-dihydroxy-2,5-dimethoxytetrahydro-3-furanyl]-4b,10a-dimethyl-4,8-dioxotetradecahydro-1-phenanthrenecarboxylate [ACD/IUPAC Name]
Methyl-(1R,3S,4aR,4bS,6R,8aR,10aR)-3-acetoxy-6-[(2S,3R,4S,5R)-3,4-dihydroxy-2,5-dimethoxytetrahydro-3-furanyl]-4b,10a-dimethyl-4,8-dioxotetradecahydro-1-phenanthrencarboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 640.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 108.3±6.0 kJ/mol
Flash Point: 207.1±25.0 °C
Index of Refraction: 1.548
Molar Refractivity: 126.4±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 4.94
ACD/KOC (pH 5.5): 109.20
ACD/LogD (pH 7.4): 1.22
ACD/BCF (pH 7.4): 4.94
ACD/KOC (pH 7.4): 109.20
Polar Surface Area: 155 Å2
Polarizability: 50.1±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 397.5±5.0 cm3

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