ChemSpider 2D Image | 13-dimethoxy glucopiericidin A | C33H51NO11

13-dimethoxy glucopiericidin A

  • Molecular FormulaC33H51NO11
  • Average mass637.758 Da
  • Monoisotopic mass637.346191 Da
  • ChemSpider ID88293816

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

(2E,4R,5R,6E,8E,11E)-13-(4-Hydroxy-5,6-dimethoxy-3-methyl-2-pyridinyl)-1,1-dimethoxy-3,5,7,11-tetramethyl-2,6,8,11-tridecatetraen-4-yl β-D-glucopyranoside [ACD/IUPAC Name]
(2E,4R,5R,6E,8E,11E)-13-(4-Hydroxy-5,6-dimethoxy-3-methyl-2-pyridinyl)-1,1-dimethoxy-3,5,7,11-tetramethyl-2,6,8,11-tridecatetraen-4-yl-β-D-glucopyranosid [German] [ACD/IUPAC Name]
13-dimethoxy glucopiericidin A
β-D-Glucopyranoside de (2E,4R,5R,6E,8E,11E)-13-(4-hydroxy-5,6-diméthoxy-3-méthyl-2-pyridinyl)-1,1-diméthoxy-3,5,7,11-tétraméthyl-2,6,8,11-tridécatétraén-4-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranoside, (1R,2R,3E,5E,8E)-1-[(1E)-3,3-dimethoxy-1-methyl-1-propen-1-yl]-10-(4-hydroxy-5,6-dimethoxy-3-methyl-2-pyridinyl)-2,4,8-trimethyl-3,5,8-decatrien-1-yl [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 829.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 126.3±3.0 kJ/mol
Flash Point: 455.2±34.3 °C
Index of Refraction: 1.567
Molar Refractivity: 169.0±0.4 cm3
#H bond acceptors: 12
#H bond donors: 5
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 3
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 0.01
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.67
ACD/LogD (pH 7.4): 0.12
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.75
Polar Surface Area: 169 Å2
Polarizability: 67.0±0.5 10-24cm3
Surface Tension: 55.9±5.0 dyne/cm
Molar Volume: 517.4±5.0 cm3

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