ChemSpider 2D Image | Strevertene B | C32H50O10

Strevertene B

  • Molecular FormulaC32H50O10
  • Average mass594.733 Da
  • Monoisotopic mass594.340393 Da
  • ChemSpider ID8683116

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 10 of 10 defined stereocentres

More details:

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

(2R,3S,4E,6E,8E,10E,12E,14R,15R,16R,18R,22S,24S,26S,27R)-27-Ethyl-14,16,18,22,24,26-hexahydroxy-2,3-dimethyl-28-oxooxacyclooctacosa-4,6,8,10,12-pentaen-15-carbonsäure [German] [ACD/IUPAC Name]
(2R,3S,4E,6E,8E,10E,12E,14R,15R,16R,18R,22S,24S,26S,27R)-27-Ethyl-14,16,18,22,24,26-hexahydroxy-2,3-dimethyl-28-oxooxacyclooctacosa-4,6,8,10,12-pentaene-15-carboxylic acid [ACD/IUPAC Name]
Acide (2R,3S,4E,6E,8E,10E,12E,14R,15R,16R,18R,22S,24S,26S,27R)-27-éthyl-14,16,18,22,24,26-hexahydroxy-2,3-diméthyl-28-oxooxacyclooctacosa-4,6,8,10,12-pentaène-15-carboxylique [French] [ACD/IUPAC Name]
Oxacyclooctacosa-4,6,8,10,12-pentaene-15-carboxylic acid, 27-ethyl-14,16,18,22,24,26-hexahydroxy-2,3-dimethyl-28-oxo-, (2R,3S,4E,6E,8E,10E,12E,14R,15R,16R,18R,22S,24S,26S,27R)- [ACD/Index Name]
Strevertene B

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

Density: 1.1±0.1 g/cm3
Boiling Point: 861.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 142.2±6.0 kJ/mol
Flash Point: 269.9±27.8 °C
Index of Refraction: 1.519
Molar Refractivity: 158.7±0.3 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 3
ACD/LogP: 1.45
ACD/LogD (pH 5.5): -0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.34
ACD/LogD (pH 7.4): -1.75
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 185 Å2
Polarizability: 62.9±0.5 10-24cm3
Surface Tension: 44.6±3.0 dyne/cm
Molar Volume: 522.4±3.0 cm3

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