ChemSpider 2D Image | (5alpha,6alpha)-3-Methoxy-7,8-didehydro-4,5-epoxymorphinan-17-ium-6-yl beta-D-glucopyranosiduronate | C23H27NO9

(5α,6α)-3-Methoxy-7,8-didehydro-4,5-epoxymorphinan-17-ium-6-yl β-D-glucopyranosiduronate

  • Molecular FormulaC23H27NO9
  • Average mass461.462 Da
  • Monoisotopic mass461.168579 Da
  • ChemSpider ID31047005
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






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

(5α,6α)-3-Methoxy-7,8-didehydro-4,5-epoxymorphinan-17-ium-6-yl β-D-glucopyranosiduronate [ACD/IUPAC Name]
(5α,6α)-3-Methoxy-7,8-didehydro-4,5-epoxymorphinan-17-ium-6-yl-β-D-glucopyranosiduronat [German] [ACD/IUPAC Name]
β-D-Glucopyranosiduronate de (5α,6α)-3-méthoxy-7,8-didéhydro-4,5-epoxymorphinane-17-ium-6-yle [French] [ACD/IUPAC Name]
β-D-Glucopyranosiduronic acid, (5α,6α)-7,8-didehydro-4,5-epoxy-3-methoxymorphinan-6-yl [ACD/Index Name]
50444-03-6 [RN]
Norcodeine O-b-D-Glucuronide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density:
Boiling Point: 723.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.0±3.0 kJ/mol
Flash Point: 391.5±32.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 2
ACD/LogP: -1.13
ACD/LogD (pH 5.5): -3.49
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 154 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site






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