ChemSpider 2D Image | cevine | C27H43NO8

cevine

  • Molecular FormulaC27H43NO8
  • Average mass509.632 Da
  • Monoisotopic mass509.298859 Da
  • ChemSpider ID16735731

  • defined stereocentres - 14 of 14 defined stereocentres

More details:

Featured data source
The Merck Index Online

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

(3a,4a,16b)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol
(3α,4α,16β)-4,9-Epoxycevan-3,4,12,14,16,17,20-heptol [German] [ACD/IUPAC Name]
(3α,4α,16β)-4,9-Epoxycevane-3,4,12,14,16,17,20-heptol [ACD/IUPAC Name]
(3α,4α,16β)-4,9-Époxycévane-3,4,12,14,16,17,20-heptol [French] [ACD/IUPAC Name]
124-98-1 [RN]
204-720-8 [EINECS]
Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, (3α,4α,16β)-
Cevane-3,4,12,14,16,17,20-heptol, 4,9-epoxy-, (3α,4α,16β)- [ACD/Index Name]
cevine
WTW6CVN18U
More...

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

7232431; 99116 [DBID]
  • Miscellaneous

    • Chemical Class:

      A steroid consisting of cevane having an oxygen bridge between positions 4 and 9 and carrying seven additional hydroxy substituents. ChEBI CHEBI:35652

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

Density: 1.5±0.1 g/cm3
Boiling Point: 693.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.9 mmHg at 25°C
Enthalpy of Vaporization: 116.2±6.0 kJ/mol
Flash Point: 373.2±31.5 °C
Index of Refraction: 1.684
Molar Refractivity: 129.0±0.4 cm3
#H bond acceptors: 9
#H bond donors: 7
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 2
ACD/LogP: 0.84
ACD/LogD (pH 5.5): -1.88
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.63
Polar Surface Area: 154 Å2
Polarizability: 51.2±0.5 10-24cm3
Surface Tension: 84.7±5.0 dyne/cm
Molar Volume: 339.7±5.0 cm3

Click to predict properties on the Chemicalize site


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