ChemSpider 2D Image | antimycin A19 | C28H40N2O9

antimycin A19

  • Molecular FormulaC28H40N2O9
  • Average mass548.625 Da
  • Monoisotopic mass548.273376 Da
  • ChemSpider ID27025657

  • defined stereocentres - 6 of 6 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

(2R,3S,6S,7R,8R)-3-[(3-Formamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-4,9-dioxo-8-pentyl-1,5-dioxonan-7-yl (2S)-2,3-dimethylbutanoate [ACD/IUPAC Name]
(2R,3S,6S,7R,8R)-3-[(3-Formamido-2-hydroxybenzoyl)amino]-2,6-dimethyl-4,9-dioxo-8-pentyl-1,5-dioxonan-7-yl-(2S)-2,3-dimethylbutanoat [German] [ACD/IUPAC Name]
(2S)-2,3-Diméthylbutanoate de (2R,3S,6S,7R,8R)-3-[(3-formamido-2-hydroxybenzoyl)amino]-2,6-diméthyl-4,9-dioxo-8-pentyl-1,5-dioxonan-7-yle [French] [ACD/IUPAC Name]
antimycin A19

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

Density: 1.2±0.1 g/cm3
Boiling Point: 753.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.6±3.0 kJ/mol
Flash Point: 409.4±32.9 °C
Index of Refraction: 1.544
Molar Refractivity: 141.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1118.22
ACD/KOC (pH 5.5): 5277.22
ACD/LogD (pH 7.4): 4.05
ACD/BCF (pH 7.4): 610.47
ACD/KOC (pH 7.4): 2880.98
Polar Surface Area: 157 Å2
Polarizability: 56.0±0.5 10-24cm3
Surface Tension: 51.9±5.0 dyne/cm
Molar Volume: 447.8±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement