ChemSpider 2D Image | glas#10 | C21H38O11

glas#10

  • Molecular FormulaC21H38O11
  • Average mass466.520 Da
  • Monoisotopic mass466.241425 Da
  • ChemSpider ID31150813

  • defined stereocentres - 10 of 10 defined stereocentres

More details:

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

1355681-37-6 [RN]
1-O-{(8R)-8-[(3,6-Dideoxy-α-L-arabino-hexopyranosyl)oxy]nonanoyl}-β-D-glucopyranose [ACD/IUPAC Name]
1-O-{(8R)-8-[(3,6-Didesoxy-α-L-arabino-hexopyranosyl)oxy]nonanoyl}-β-D-glucopyranose [German] [ACD/IUPAC Name]
1-O-{(8R)-8-[(3,6-Didésoxy-α-L-arabino-hexopyranosyl)oxy]nonanoyl}-β-D-glucopyranose [French] [ACD/IUPAC Name]
glas#10
β-D-Glucopyranose, 1-O-[(8R)-8-[(3,6-dideoxy-α-L-arabino-hexopyranosyl)oxy]-1-oxononyl]- [ACD/Index Name]
1-O-(8R-(3,6-dideoxy-α-L-arabino-hexopyranosyloxy)-nonanoyl)-β-D-glucopyranose
β-D-glucos-1''-yl-8R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-nonanoate
β-D-glucos-1''-yl-8R-(3'R,5'R-dihydroxy-6'S-methyl-(2H)-tetrahydropyran-2'-yloxy)-nonaoate
  • Miscellaneous

    • Chemical Class:

      An ascarosyloxycarboxylic acid <stereo>beta</stereo>-<stereo>D</stereo>-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#10 with the anomeric hydroxy group of <stereo>beta</stereo>-<stereo>D</stereo>-glucopyranose. It is a metabolite of the nematode <ital>Caenorhabditis elegans</ital>. ChEBI CHEBI:79301
      An ascarosyloxycarboxylic acid beta-D-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#10 with the anomeric hydroxy group of beta-D-glucopyranose. It is a met abolite of the nematode Caenorhabditis elegans. ChEBI CHEBI:79301
      An ascarosyloxycarboxylic acid beta-D-glucopyranosyl ester resulting from the formal esterification of the carboxy group of ascr#10 with the anomeric hydroxy group of; beta-D-glucopyranose. It is a m etabolite of the nematode Caenorhabditis elegans. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:79301

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

Density: 1.3±0.1 g/cm3
Boiling Point: 659.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.5 mmHg at 25°C
Enthalpy of Vaporization: 111.1±6.0 kJ/mol
Flash Point: 221.2±25.0 °C
Index of Refraction: 1.554
Molar Refractivity: 111.3±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 0.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 25.08
ACD/LogD (pH 7.4): 0.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 25.08
Polar Surface Area: 175 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 63.5±5.0 dyne/cm
Molar Volume: 347.3±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement