ChemSpider 2D Image | Erythrophleine | C24H39NO5

Erythrophleine

  • Molecular FormulaC24H39NO5
  • Average mass421.570 Da
  • Monoisotopic mass421.282837 Da
  • ChemSpider ID32701236

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(7β,13E,14α)-7-Hydroxy-14-méthyl-13-{2-[2-(méthylamino)éthoxy]-2-oxoéthylidène}podocarpan-16-oate de méthyle [French] [ACD/IUPAC Name]
1-Phenanthrenecarboxylic acid, tetradecahydro-9-hydroxy-1,4a,8-trimethyl-7-[2-[2-(methylamino)ethoxy]-2-oxoethylidene]-, methyl ester, (1S,4aR,4bS,7E,8R,8aS,9S,10aR)- [ACD/Index Name]
Erythrophleine
Methyl (7β,13E,14α)-7-hydroxy-14-methyl-13-{2-[2-(methylamino)ethoxy]-2-oxoethylidene}podocarpan-16-oate [ACD/IUPAC Name]
Methyl-(7β,13E,14α)-7-hydroxy-14-methyl-13-{2-[2-(methylamino)ethoxy]-2-oxoethyliden}podocarpan-16-oat [German] [ACD/IUPAC Name]
Norcassamidine

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

UVD3Q9V368 [DBID]
UNII:UVD3Q9V368 [DBID]
UNII-UVD3Q9V368 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 525.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 92.0±6.0 kJ/mol
Flash Point: 271.6±30.1 °C
Index of Refraction: 1.534
Molar Refractivity: 117.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 1.25
ACD/BCF (pH 5.5): 1.08
ACD/KOC (pH 5.5): 5.58
ACD/LogD (pH 7.4): 2.75
ACD/BCF (pH 7.4): 33.67
ACD/KOC (pH 7.4): 174.82
Polar Surface Area: 85 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 42.9±3.0 dyne/cm
Molar Volume: 377.2±3.0 cm3

Click to predict properties on the Chemicalize site


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