ChemSpider 2D Image | (5R)-3,5-Dihydroxy-7-[(1S,2S,6S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylpentanoyl]oxy}-1,2,6,7,8,8a-hexahydro-1-naphthalenyl]heptanoic acid | C24H38O7

(5R)-3,5-Dihydroxy-7-[(1S,2S,6S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylpentanoyl]oxy}-1,2,6,7,8,8a-hexahydro-1-naphthalenyl]heptanoic acid

  • Molecular FormulaC24H38O7
  • Average mass438.554 Da
  • Monoisotopic mass438.261749 Da
  • ChemSpider ID23976771

  • defined stereocentres - 6 of 8 defined stereocentres

More details:

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

(5R)-3,5-Dihydroxy-7-[(1S,2S,6S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylpentanoyl]oxy}-1,2,6,7,8,8a-hexahydro-1-naphthalenyl]heptanoic acid [ACD/IUPAC Name]
(5R)-3,5-Dihydroxy-7-[(1S,2S,6S,8aR)-6-hydroxy-2-methyl-8-{[(2S)-2-methylpentanoyl]oxy}-1,2,6,7,8,8a-hexahydro-1-naphthalinyl]heptansäure [German] [ACD/IUPAC Name]
1-Naphthaleneheptanoic acid, 1,2,6,7,8,8a-hexahydro-β,δ,6-trihydroxy-2-methyl-8-[[(2S)-2-methyl-1-oxopentyl]oxy]-, (δR,1S,2S,6S,8aR)- [ACD/Index Name]
Acide (5R)-3,5-dihydroxy-7-[(1S,2S,6S,8aR)-6-hydroxy-2-méthyl-8-{[(2S)-2-méthylpentanoyl]oxy}-1,2,6,7,8,8a-hexahydro-1-naphtalényl]heptanoïque [French] [ACD/IUPAC Name]
159345-66-1 [RN]
Homopravastatin

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

Density: 1.2±0.1 g/cm3
Boiling Point: 642.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.3 mmHg at 25°C
Enthalpy of Vaporization: 108.6±6.0 kJ/mol
Flash Point: 213.5±25.0 °C
Index of Refraction: 1.551
Molar Refractivity: 116.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 0
ACD/LogP: 1.88
ACD/LogD (pH 5.5): 1.31
ACD/BCF (pH 5.5): 2.82
ACD/KOC (pH 5.5): 30.98
ACD/LogD (pH 7.4): -0.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 124 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 365.3±5.0 cm3

Click to predict properties on the Chemicalize site


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