ChemSpider 2D Image | 2,16,20-Trihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholest-5-en-25-yl acetate | C32H48O8

2,16,20-Trihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholest-5-en-25-yl acetate

  • Molecular FormulaC32H48O8
  • Average mass560.719 Da
  • Monoisotopic mass560.334900 Da
  • ChemSpider ID511399

More details:

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

2,16,20-Trihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholest-5-en-25-yl acetate [ACD/IUPAC Name]
2,16,20-Trihydroxy-9,10,14-trimethyl-1,11,22-trioxo-4,9-cyclo-9,10-secocholest-5-en-25-yl-acetat [German] [ACD/IUPAC Name]
Acétate de 2,16,20-trihydroxy-9,10,14-triméthyl-1,11,22-trioxo-4,9-cyclo-9,10-sécocholest-5-én-25-yle [French] [ACD/IUPAC Name]
Estr-5-ene-3,11-dione, 17-[5-(acetyloxy)-1-hydroxy-1,5-dimethyl-2-oxohexyl]-2,16-dihydroxy-4,4,9,14-tetramethyl- [ACD/Index Name]
13201-14-4 [RN]
19-Norlast-5-ene-3,11,22-trione, 25-(acetyloxy)-2,16,20-trihydroxy-9-methyl-, (2β,9β,10α,16α)-
5-(2,16-Dihydroxy-4,4,9,14-tetramethyl-3,11-dioxoestr-5-en-17-yl)-5-hydroxy-1,1-dimethyl-4-oxohexyl acetate
Cucurbitacin B, 23,24-dihydro-
Cucurbitacin B, dihydro-
DIHYDROCUCURBITACIN B

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

NSC 106401 [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: 692.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 116.0±6.0 kJ/mol
Flash Point: 215.4±25.0 °C
Index of Refraction: 1.559
Molar Refractivity: 148.5±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 2.56
ACD/LogD (pH 5.5): 3.01
ACD/BCF (pH 5.5): 113.36
ACD/KOC (pH 5.5): 1028.47
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 113.36
ACD/KOC (pH 7.4): 1028.47
Polar Surface Area: 138 Å2
Polarizability: 58.9±0.5 10-24cm3
Surface Tension: 52.4±5.0 dyne/cm
Molar Volume: 460.0±5.0 cm3

Click to predict properties on the Chemicalize site


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