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ChemSpider 2D Image | lucidenic acid P | C29H42O8

lucidenic acid P

  • Molecular FormulaC29H42O8
  • Average mass518.639 Da
  • Monoisotopic mass518.287964 Da
  • ChemSpider ID9378228
  • defined stereocentres - 9 of 9 defined stereocentres

More details:

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

(3β,5α,7β,12β)-12-Acetoxy-3,7-dihydroxy-4,4,14-trimethyl-11,15-dioxochol-8-en-24-oic acid [ACD/IUPAC Name]
(3β,5α,7β,12β)-12-Acetoxy-3,7-dihydroxy-4,4,14-trimethyl-11,15-dioxochol-8-en-24-säure [German] [ACD/IUPAC Name]
Acide (3β,5α,7β,12β)-12-acétoxy-3,7-dihydroxy-4,4,14-triméthyl-11,15-dioxochol-8-én-24-oïque [French] [ACD/IUPAC Name]
Chol-8-en-24-oic acid, 12-(acetyloxy)-3,7-dihydroxy-4,4,14-trimethyl-11,15-dioxo-, (3β,5α,7β,12β)- [ACD/Index Name]
lucidenic acid P
(3β,5α,7β,12β)-12-(acetyloxy)-3,7-dihydroxy-4,4,14-trimethyl-11,15-dioxochol-8-en-24-oic acid
3β,7β-dihydroxy-12β-acetoxy-25,26,27-trinor-11,15-dioxolanost-8-en-24-oic acid

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 677.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.8±6.0 kJ/mol
Flash Point: 217.3±25.0 °C
Index of Refraction: 1.567
Molar Refractivity: 134.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.38
ACD/LogD (pH 5.5): 1.98
ACD/BCF (pH 5.5): 11.69
ACD/KOC (pH 5.5): 115.92
ACD/LogD (pH 7.4): 0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.84
Polar Surface Area: 138 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 54.7±5.0 dyne/cm
Molar Volume: 411.4±5.0 cm3

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