ChemSpider 2D Image | (5xi,7beta,15alpha,25R)-7,15-Dihydroxy-3,11,23-trioxolanost-8-en-26-oic acid | C30H44O7

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

  • Molecular FormulaC30H44O7
  • Average mass516.666 Da
  • Monoisotopic mass516.308716 Da
  • ChemSpider ID30805165

  • defined stereocentres - 8 of 9 defined stereocentres

More details:

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

(5ξ,7β,15α,25R)-7,15-Dihydroxy-3,11,23-trioxolanost-8-en-26-oic acid [ACD/IUPAC Name]
(5ξ,7β,15α,25R)-7,15-Dihydroxy-3,11,23-trioxolanost-8-en-26-säure [German] [ACD/IUPAC Name]
Acide (5ξ,7β,15α,25R)-7,15-dihydroxy-3,11,23-trioxolanost-8-én-26-oïque [French] [ACD/IUPAC Name]
Lanost-8-en-26-oic acid, 7,15-dihydroxy-3,11,23-trioxo-, (5ξ,7β,15α,25R)- [ACD/Index Name]
(2R,6R)-6-((7S,10S,13R,14R,15S,17R)-7,15-Dihydroxy-4,4,10,13,14-pentamethyl-3,11-dioxo-2,3,4,5,6,7,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)-2-methyl-4-oxoheptanoic acid
(2R,6R)-6-[(1R,3S,3aR,4S,9aS,11aR)-3,4-dihydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-1H,2H,3H,3aH,4H,5H,5aH,6H,7H,8H,9H,9aH,10H,11H,11aH-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
(2R,6R)-6-[(1R,3S,3aR,4S,9aS,11aR)-3,4-dihydroxy-3a,6,6,9a,11a-pentamethyl-7,10-dioxo-1H,2H,3H,4H,5H,5aH,8H,9H,11H-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
81907-62-2 [RN]
GANODERIC ACID
Ganoderic acid A [Wiki]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 690.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 115.7±6.0 kJ/mol
Flash Point: 385.1±28.0 °C
Index of Refraction: 1.565
Molar Refractivity: 137.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 10.81
ACD/KOC (pH 5.5): 113.46
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.82
Polar Surface Area: 129 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 421.5±5.0 cm3

Click to predict properties on the Chemicalize site


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