ChemSpider 2D Image | (3beta,5xi,7beta,15alpha,17xi,20Z,25R)-3,7,15-Trihydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid | C30H44O7

(3β,5ξ,7β,15α,17ξ,20Z,25R)-3,7,15-Trihydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid

  • Molecular FormulaC30H44O7
  • Average mass516.666 Da
  • Monoisotopic mass516.308716 Da
  • ChemSpider ID81369518

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 9 defined stereocentres

More details:

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

(3β,5ξ,7β,15α,17ξ,20Z,25R)-3,7,15-Trihydroxy-11,23-dioxolanosta-8,20(22)-dien-26-oic acid [ACD/IUPAC Name]
(3β,5ξ,7β,15α,17ξ,20Z,25R)-3,7,15-Trihydroxy-11,23-dioxolanosta-8,20(22)-dien-26-säure [German] [ACD/IUPAC Name]
Acide (3β,5ξ,7β,15α,17ξ,20Z,25R)-3,7,15-trihydroxy-11,23-dioxolanosta-8,20(22)-dién-26-oïque [French] [ACD/IUPAC Name]
Lanosta-8,20(22)-dien-26-oic acid, 3,7,15-trihydroxy-11,23-dioxo-, (3β,5ξ,7β,15α,17ξ,20Z,25R)- [ACD/Index Name]
100665-42-7 [RN]
Ganoderenic acid C

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

Density: 1.2±0.1 g/cm3
Boiling Point: 700.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.0 mmHg at 25°C
Enthalpy of Vaporization: 117.3±6.0 kJ/mol
Flash Point: 391.6±29.4 °C
Index of Refraction: 1.581
Molar Refractivity: 138.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.04
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 21.01
ACD/KOC (pH 5.5): 165.51
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.60
Polar Surface Area: 132 Å2
Polarizability: 54.8±0.5 10-24cm3
Surface Tension: 55.7±5.0 dyne/cm
Molar Volume: 415.2±5.0 cm3

Click to predict properties on the Chemicalize site


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