ChemSpider 2D Image | 1-O-({(2E,4Z,6R)-7-[4-(Dimethylamino)phenyl]-4,6-dimethyl-7-oxo-2,4-heptadienoyl}amino)-beta-D-glucopyranose | C23H32N2O8

1-O-({(2E,4Z,6R)-7-[4-(Dimethylamino)phenyl]-4,6-dimethyl-7-oxo-2,4-heptadienoyl}amino)-β-D-glucopyranose

  • Molecular FormulaC23H32N2O8
  • Average mass464.509 Da
  • Monoisotopic mass464.215851 Da
  • ChemSpider ID59701377

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

1-O-({(2E,4Z,6R)-7-[4-(Dimethylamino)phenyl]-4,6-dimethyl-7-oxo-2,4-heptadienoyl}amino)-β-D-glucopyranose [German] [ACD/IUPAC Name]
1-O-({(2E,4Z,6R)-7-[4-(Dimethylamino)phenyl]-4,6-dimethyl-7-oxo-2,4-heptadienoyl}amino)-β-D-glucopyranose [ACD/IUPAC Name]
1-O-({(2E,4Z,6R)-7-[4-(Diméthylamino)phényl]-4,6-diméthyl-7-oxo-2,4-heptadienoyl}amino)-β-D-glucopyranose [French] [ACD/IUPAC Name]
β-D-Glucopyranose, 1-O-[[(2E,4Z,6R)-7-[4-(dimethylamino)phenyl]-4,6-dimethyl-1,7-dioxo-2,4-heptadien-1-yl]amino]- [ACD/Index Name]
Trichostatin C

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.608
Molar Refractivity: 120.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.46
ACD/KOC (pH 5.5): 45.66
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.46
ACD/KOC (pH 7.4): 45.68
Polar Surface Area: 149 Å2
Polarizability: 47.7±0.5 10-24cm3
Surface Tension: 64.7±5.0 dyne/cm
Molar Volume: 347.8±5.0 cm3

Click to predict properties on the Chemicalize site


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