ChemSpider 2D Image | (2E,6E,11E)-18-(2,6-Dioxo-4-piperidinyl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxo-2,6,11-octadecatrienoic acid | C27H41NO8

(2E,6E,11E)-18-(2,6-Dioxo-4-piperidinyl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxo-2,6,11-octadecatrienoic acid

  • Molecular FormulaC27H41NO8
  • Average mass507.616 Da
  • Monoisotopic mass507.283203 Da
  • ChemSpider ID8024838

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E,6E,11E)-18-(2,6-Dioxo-4-piperidinyl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxo-2,6,11-octadecatrienoic acid [ACD/IUPAC Name]
(2E,6E,11E)-18-(2,6-Dioxo-4-piperidinyl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxo-2,6,11-octadecatriensäure [German] [ACD/IUPAC Name]
2,6,11-Octadecatrienoic acid, 18-(2,6-dioxo-4-piperidinyl)-9,13-dihydroxy-8-methoxy-10,12,14-trimethyl-15-oxo-, (2E,6E,11E)- [ACD/Index Name]
Acide (2E,6E,11E)-18-(2,6-dioxo-4-pipéridinyl)-9,13-dihydroxy-8-méthoxy-10,12,14-triméthyl-15-oxo-2,6,11-octadécatriénoïque [French] [ACD/IUPAC Name]
Dorrigocin A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 738.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 123.0±6.0 kJ/mol
Flash Point: 400.7±32.9 °C
Index of Refraction: 1.527
Molar Refractivity: 134.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 1.05
ACD/BCF (pH 5.5): 2.28
ACD/KOC (pH 5.5): 35.56
ACD/LogD (pH 7.4): -0.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 150 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 438.8±3.0 cm3

Click to predict properties on the Chemicalize site


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