ChemSpider 2D Image | oleandolide | C20H34O7

oleandolide

  • Molecular FormulaC20H34O7
  • Average mass386.480 Da
  • Monoisotopic mass386.230438 Da
  • ChemSpider ID20016206
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






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

(-)-Oleandolide
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6,12,14-Trihydroxy-5,7,8,11,13,15-hexamethyl-1,9-dioxaspiro[2.13]hexadecan-4,10-dion [German] [ACD/IUPAC Name]
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6,12,14-Trihydroxy-5,7,8,11,13,15-hexamethyl-1,9-dioxaspiro[2.13]hexadecane-4,10-dione [ACD/IUPAC Name]
(3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)-6,12,14-Trihydroxy-5,7,8,11,13,15-hexaméthyl-1,9-dioxaspiro[2.13]hexadécane-4,10-dione [French] [ACD/IUPAC Name]
1,9-Dioxaspiro[2.13]hexadecane-4,10-dione, 6,12,14-trihydroxy-5,7,8,11,13,15-hexamethyl-, (3R,5R,6S,7R,8R,11R,12S,13R,14S,15S)- [ACD/Index Name]
68540-16-9 [RN]
oleandolide
Oleandomycin aglycone
Oleandonolide

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

CHEBI:29658 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 591.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.8 mmHg at 25°C
Enthalpy of Vaporization: 101.3±6.0 kJ/mol
Flash Point: 203.4±23.6 °C
Index of Refraction: 1.521
Molar Refractivity: 98.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.06
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.74
ACD/KOC (pH 5.5): 51.65
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.74
ACD/KOC (pH 7.4): 51.65
Polar Surface Area: 117 Å2
Polarizability: 39.1±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 323.9±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement