ChemSpider 2D Image | 4-Hydroxy-1,26-dioxo-5,6:22,26-diepoxyergosta-2,24-dien-18-yl acetate | C30H40O7

4-Hydroxy-1,26-dioxo-5,6:22,26-diepoxyergosta-2,24-dien-18-yl acetate

  • Molecular FormulaC30H40O7
  • Average mass512.634 Da
  • Monoisotopic mass512.277405 Da
  • ChemSpider ID373125

More details:

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

4-Hydroxy-1,26-dioxo-5,6:22,26-diepoxyergosta-2,24-dien-18-yl acetate [ACD/IUPAC Name]
4-Hydroxy-1,26-dioxo-5,6:22,26-diepoxyergosta-2,24-dien-18-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 4-hydroxy-1,26-dioxo-5,6:22,26-diépoxyergosta-2,24-dién-18-yle [French] [ACD/IUPAC Name]
Ergosta-2,24-diene-1,26-dione, 18-(acetyloxy)-5,6:22,26-diepoxy-4-hydroxy- [ACD/Index Name]
(9-[1-(4,5-Dimethyl-6-oxo-3,6-dihydro-2H-pyran-2-yl)ethyl]-4-hydroxy-11b-methyl-1-oxo-1,5a,6,6a,6b,7,8,9,10,11,11a,11b-dodecahydrocyclopenta[1,2]phenanthro[8a,9-b]oxiren-9a(4H)-yl)methyl acetate
5β-Ergosta-2,24-dien-26-oic acid, 5,6β-epoxy-4β,18,22-trihydroxy-1-oxo-, δ-lactone, 18-acetate, (20S,22R)-
Ergosta-2,24-dien-26-oic acid, 18-(acetyloxy)-5,6-epoxy-4,22-dihydroxy-1-oxo-, δ-lactone, (4β,5β,6β,22R)-
WITHACNISTIN

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

NSC135073 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 675.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.7 mmHg at 25°C
Enthalpy of Vaporization: 113.4±6.0 kJ/mol
Flash Point: 218.9±25.0 °C
Index of Refraction: 1.582
Molar Refractivity: 135.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 3.37
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 245.11
ACD/KOC (pH 5.5): 1786.10
ACD/LogD (pH 7.4): 3.45
ACD/BCF (pH 7.4): 245.11
ACD/KOC (pH 7.4): 1786.10
Polar Surface Area: 102 Å2
Polarizability: 53.5±0.5 10-24cm3
Surface Tension: 52.4±5.0 dyne/cm
Molar Volume: 404.7±5.0 cm3

Click to predict properties on the Chemicalize site


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