ChemSpider 2D Image | (24S,25R)-24,25-Dihydroxy-3-oxolanosta-7,9(11)-dien-27-yl (2Z,5E)-2-[2-(2,5-dihydroxyphenyl)ethylidene]-6,10-dimethyl-5,9-undecadienoate | C51H74O7

(24S,25R)-24,25-Dihydroxy-3-oxolanosta-7,9(11)-dien-27-yl (2Z,5E)-2-[2-(2,5-dihydroxyphenyl)ethylidene]-6,10-dimethyl-5,9-undecadienoate

  • Molecular FormulaC51H74O7
  • Average mass799.129 Da
  • Monoisotopic mass798.543457 Da
  • ChemSpider ID59000647

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(24S,25R)-24,25-Dihydroxy-3-oxolanosta-7,9(11)-dien-27-yl (2Z,5E)-2-[2-(2,5-dihydroxyphenyl)ethylidene]-6,10-dimethyl-5,9-undecadienoate [ACD/IUPAC Name]
(24S,25R)-24,25-Dihydroxy-3-oxolanosta-7,9(11)-dien-27-yl-(2Z,5E)-2-[2-(2,5-dihydroxyphenyl)ethyliden]-6,10-dimethyl-5,9-undecadienoat [German] [ACD/IUPAC Name]
(2Z,5E)-2-[2-(2,5-Dihydroxyphényl)éthylidène]-6,10-diméthyl-5,9-undécadiénoate de (24S,25R)-24,25-dihydroxy-3-oxolanosta-7,9(11)-dién-27-yle [French] [ACD/IUPAC Name]
5,9-Undecadienoic acid, 2-[2-(2,5-dihydroxyphenyl)ethylidene]-6,10-dimethyl-, (24S,25R)-24,25-dihydroxy-3-oxolanosta-7,9(11)-dien-27-yl ester, (2Z,5E)- [ACD/Index Name]
Ganoleuconin M

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

Density: 1.1±0.1 g/cm3
Boiling Point: 874.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 133.2±3.0 kJ/mol
Flash Point: 245.0±27.8 °C
Index of Refraction: 1.581
Molar Refractivity: 233.4±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 2
ACD/LogP: 12.56
ACD/LogD (pH 5.5): 11.58
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.58
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 124 Å2
Polarizability: 92.5±0.5 10-24cm3
Surface Tension: 51.5±5.0 dyne/cm
Molar Volume: 700.5±5.0 cm3

Click to predict properties on the Chemicalize site


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