Found 1 result

Search term: FKEFZHOEVVYKSI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | hippuristerone A | C33H52O7

hippuristerone A

  • Molecular FormulaC33H52O7
  • Average mass560.762 Da
  • Monoisotopic mass560.371277 Da
  • ChemSpider ID10273620
  • defined stereocentres - 12 of 12 defined stereocentres


More details:






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

(5α,16β,17α,22R,23S)-16-Hydroxy-23-methyl-3-oxo-17,20-epoxyergostan-22,25-diyl-diacetat [German] [ACD/IUPAC Name]
(5α,16β,17α,22R,23S)-16-Hydroxy-23-methyl-3-oxo-17,20-epoxyergostane-22,25-diyl diacetate [ACD/IUPAC Name]
Diacétate de (5α,16β,17α,22R,23S)-16-hydroxy-23-méthyl-3-oxo-17,20-époxyergostane-22,25-diyle [French] [ACD/IUPAC Name]
Ergostan-3-one, 22,25-bis(acetyloxy)-17,20-epoxy-16-hydroxy-23-methyl-, (5α,16β,17α,22R,23S)- [ACD/Index Name]
hippuristerone A

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

Density: 1.2±0.1 g/cm3
Boiling Point: 635.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.2 mmHg at 25°C
Enthalpy of Vaporization: 107.5±6.0 kJ/mol
Flash Point: 192.6±25.0 °C
Index of Refraction: 1.536
Molar Refractivity: 151.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.07
ACD/LogD (pH 5.5): 5.14
ACD/BCF (pH 5.5): 4714.02
ACD/KOC (pH 5.5): 14825.39
ACD/LogD (pH 7.4): 5.14
ACD/BCF (pH 7.4): 4714.02
ACD/KOC (pH 7.4): 14825.39
Polar Surface Area: 102 Å2
Polarizability: 60.1±0.5 10-24cm3
Surface Tension: 45.6±5.0 dyne/cm
Molar Volume: 486.2±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement