Found 1 result

Search term: 78445014 (Found by CSID)
ChemSpider 2D Image | (4E)-7-Hydroxy-N-{(3E,5E,7E,10Z,12E,14E,16E,18E)-11-hydroxy-19-[(2S,3S,4R)-3-methoxy-2,4-dimethyl-5-oxotetrahydro-2-furanyl]-5,15-dimethyl-9-oxo-3,5,7,10,12,14,16,18-nonadecaoctaen-2-yl}-8-(4-hydroxyp henyl)-2-methyl-4-octenamide (non-preferred name) | C43H55NO8

(4E)-7-Hydroxy-N-{(3E,5E,7E,10Z,12E,14E,16E,18E)-11-hydroxy-19-[(2S,3S,4R)-3-methoxy-2,4-dimethyl-5-oxotetrahydro-2-furanyl]-5,15-dimethyl-9-oxo-3,5,7,10,12,14,16,18-nonadecaoctaen-2-yl}-8-(4-hydroxyp henyl)-2-methyl-4-octenamide (non-preferred name)

  • Molecular FormulaC43H55NO8
  • Average mass713.899 Da
  • Monoisotopic mass713.392761 Da
  • ChemSpider ID78445014

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 6 defined stereocentres

More details:

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

(4E)-7-Hydroxy-N-{(3E,5E,7E,10Z,12E,14E,16E,18E)-11-hydroxy-19-[(2S,3S,4R)-3-methoxy-2,4-dimethyl-5-oxotetrahydro-2-furanyl]-5,15-dimethyl-9-oxo-3,5,7,10,12,14,16,18-nonadecaoctaen-2-yl}-8-(4-hydroxyp henyl)-2-methyl-4-octenamid (non-preferred name) [German] [ACD/IUPAC Name]
(4E)-7-Hydroxy-N-{(3E,5E,7E,10Z,12E,14E,16E,18E)-11-hydroxy-19-[(2S,3S,4R)-3-methoxy-2,4-dimethyl-5-oxotetrahydro-2-furanyl]-5,15-dimethyl-9-oxo-3,5,7,10,12,14,16,18-nonadecaoctaen-2-yl}-8-(4-hydroxyp henyl)-2-methyl-4-octenamide (non-preferred name) [ACD/IUPAC Name]
(4E)-7-Hydroxy-N-{(3E,5E,7E,10Z,12E,14E,16E,18E)-11-hydroxy-19-[(2S,3S,4R)-3-méthoxy-2,4-diméthyl-5-oxotétrahydro-2-furanyl]-5,15-diméthyl-9-oxo-3,5,7,10,12,14,16,18-nonadécaoctaén-2-yl}-8-(4-hydroxyp hényl)-2-méthyl-4-octénamide (non-preferred name) [French] [ACD/IUPAC Name]
Thailandamide lactone

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

Density: 1.2±0.1 g/cm3
Boiling Point: 933.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 142.3±3.0 kJ/mol
Flash Point: 518.6±34.3 °C
Index of Refraction: 1.587
Molar Refractivity: 206.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 19
#Rule of 5 Violations: 1
ACD/LogP: 4.91
ACD/LogD (pH 5.5): 4.68
ACD/BCF (pH 5.5): 2138.96
ACD/KOC (pH 5.5): 8417.28
ACD/LogD (pH 7.4): 4.64
ACD/BCF (pH 7.4): 1914.88
ACD/KOC (pH 7.4): 7535.48
Polar Surface Area: 142 Å2
Polarizability: 81.9±0.5 10-24cm3
Surface Tension: 52.4±5.0 dyne/cm
Molar Volume: 614.8±5.0 cm3

Click to predict properties on the Chemicalize site


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