ChemSpider 2D Image | (3beta,5xi,12beta,25R)-3,12-Dihydroxy-7,11,15,23-tetraoxolanost-8-en-26-oic acid | C30H42O8

(3β,5ξ,12β,25R)-3,12-Dihydroxy-7,11,15,23-tetraoxolanost-8-en-26-oic acid

  • Molecular FormulaC30H42O8
  • Average mass530.650 Da
  • Monoisotopic mass530.287964 Da
  • ChemSpider ID57257080

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(3β,5ξ,12β,25R)-3,12-Dihydroxy-7,11,15,23-tetraoxolanost-8-en-26-oic acid [ACD/IUPAC Name]
(3β,5ξ,12β,25R)-3,12-Dihydroxy-7,11,15,23-tetraoxolanost-8-en-26-säure [German] [ACD/IUPAC Name]
Acide (3β,5ξ,12β,25R)-3,12-dihydroxy-7,11,15,23-tétraoxolanost-8-én-26-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-26-oic acid, 3,12-dihydroxy-7,11,15,23-tetraoxo-, (3β,5ξ,12β,25R)- [ACD/Index Name]
(2R,6R)-6-[(3S,10S,12S,13R,14R,17R)-3,12-Dihydroxy-4,4,10,13,14-pentamethyl-7,11,15-trioxo-1,2,3,5,6,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
105742-76-5 [RN]
CID 102004760
Ganoderic acid C
Ganoderic acid C6

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

Density: 1.3±0.1 g/cm3
Boiling Point: 708.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.4±6.0 kJ/mol
Flash Point: 396.1±29.4 °C
Index of Refraction: 1.570
Molar Refractivity: 137.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.06
ACD/LogD (pH 5.5): 1.57
ACD/BCF (pH 5.5): 5.91
ACD/KOC (pH 5.5): 73.14
ACD/LogD (pH 7.4): -0.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.17
Polar Surface Area: 146 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 55.9±5.0 dyne/cm
Molar Volume: 418.3±5.0 cm3

Click to predict properties on the Chemicalize site


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