ChemSpider 2D Image | Ganoderic acid C | C30H42O7

Ganoderic acid C

  • Molecular FormulaC30H42O7
  • Average mass514.650 Da
  • Monoisotopic mass514.293030 Da
  • ChemSpider ID413670

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(7β,25R)-7-Hydroxy-3,11,15,23-tetraoxolanost-8-en-26-oic acid [ACD/IUPAC Name]
(7β,25R)-7-Hydroxy-3,11,15,23-tetraoxolanost-8-en-26-säure [German] [ACD/IUPAC Name]
95311-97-0 [RN]
Acide (7β,25R)-7-hydroxy-3,11,15,23-tétraoxolanost-8-én-26-oïque [French] [ACD/IUPAC Name]
Ganoderic acid C
Ganoderic acid C1
Lanost-8-en-26-oic acid, 7-hydroxy-3,11,15,23-tetraoxo-, (7β,25R)- [ACD/Index Name]
(2R,6R)-6-[(1R,3aR,4S,5aR,9aS,11aR)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,7,10-trioxo-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,3aR,4S,5aR,9aS,11aR)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,7,10-trioxo-1H,2H,4H,5H,5aH,8H,9H,11H-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxoheptanoic acid
(2R,6R)-6-[(5R,7S,10S,13R,14R,17R)-7-hydroxy-4,4,10,13,14-pentamethyl-3,11,15-trioxo-1,2,5,6,7,12,16,17-octahydrocyclopenta[a]phenanthren-17-yl]-2-methyl-4-oxoheptanoic acid
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

AIDS070761 [DBID]
AIDS-070761 [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: 688.3±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±4.9 mmHg at 25°C
    Enthalpy of Vaporization: 115.4±6.0 kJ/mol
    Flash Point: 384.1±28.0 °C
    Index of Refraction: 1.559
    Molar Refractivity: 135.8±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 1
    ACD/LogP: 2.43
    ACD/LogD (pH 5.5): 1.86
    ACD/BCF (pH 5.5): 9.74
    ACD/KOC (pH 5.5): 104.76
    ACD/LogD (pH 7.4): 0.06
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.68
    Polar Surface Area: 126 Å2
    Polarizability: 53.8±0.5 10-24cm3
    Surface Tension: 52.0±5.0 dyne/cm
    Molar Volume: 420.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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