ChemSpider 2D Image | Katimborine | C22H29NO11

Katimborine

  • Molecular FormulaC22H29NO11
  • Average mass483.466 Da
  • Monoisotopic mass483.174072 Da
  • ChemSpider ID28429418
  • defined stereocentres - 10 of 10 defined stereocentres


More details:






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

1-Methyl-2-oxo-1,2-dihydro-4-chinolinyl-2-O-(6-desoxy-α-L-mannopyranosyl)-β-D-glucopyranosid [German] [ACD/IUPAC Name]
1-Methyl-2-oxo-1,2-dihydro-4-quinolinyl 2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranoside [ACD/IUPAC Name]
2(1H)-Quinolinone, 4-[[2-O-(6-deoxy-α-L-mannopyranosyl)-β-D-glucopyranosyl]oxy]-1-methyl- [ACD/Index Name]
2-O-(6-Désoxy-α-L-mannopyranosyl)-β-D-glucopyranoside de 1-méthyl-2-oxo-1,2-dihydro-4-quinoléinyle [French] [ACD/IUPAC Name]
Katimborine
N-methyl-4-O-[α-L-rhamnopyranosyl-(1->2)β-D-glucopyranosyl]-2-quinolone
N-methyl-4-O-β-neohesperidosyl-2-quinolone

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

Density: 1.6±0.1 g/cm3
Boiling Point: 747.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.4±3.0 kJ/mol
Flash Point: 406.1±32.9 °C
Index of Refraction: 1.672
Molar Refractivity: 114.3±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 1.62
ACD/LogD (pH 5.5): -0.34
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 15.66
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 15.66
Polar Surface Area: 179 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 87.0±5.0 dyne/cm
Molar Volume: 305.4±5.0 cm3

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