ChemSpider 2D Image | claviridin A | C25H34O8

claviridin A

  • Molecular FormulaC25H34O8
  • Average mass462.533 Da
  • Monoisotopic mass462.225372 Da
  • ChemSpider ID27025432

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(4R,5E,7E,12α,14Z,16R)-4,12-Diacétoxy-16-hydroxy-9-oxoprosta-5,7,10,14-tétraén-1-oate de méthyle [French] [ACD/IUPAC Name]
claviridin A
Methyl (4R,5E,7E,12α,14Z,16R)-4,12-diacetoxy-16-hydroxy-9-oxoprosta-5,7,10,14-tetraen-1-oate [ACD/IUPAC Name]
Methyl-(4R,5E,7E,12α,14Z,16R)-4,12-diacetoxy-16-hydroxy-9-oxoprosta-5,7,10,14-tetraen-1-oat [German] [ACD/IUPAC Name]
Prosta-5,7,10,14-tetraen-1-oic acid, 4,12-bis(acetyloxy)-16-hydroxy-9-oxo-, methyl ester, (4R,5E,7E,12α,14Z,16R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 590.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.2±6.0 kJ/mol
Flash Point: 190.8±23.6 °C
Index of Refraction: 1.528
Molar Refractivity: 122.4±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 212.09
ACD/KOC (pH 5.5): 1610.38
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 212.09
ACD/KOC (pH 7.4): 1610.38
Polar Surface Area: 116 Å2
Polarizability: 48.5±0.5 10-24cm3
Surface Tension: 46.9±5.0 dyne/cm
Molar Volume: 397.4±5.0 cm3

Click to predict properties on the Chemicalize site


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