ChemSpider 2D Image | (3beta)-3-{[2-O-(beta-D-Galactopyranosyl)-alpha-L-arabinopyranosyl]oxy}lanosta-8,24-dien-30-oic acid | C41H66O12

(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}lanosta-8,24-dien-30-oic acid

  • Molecular FormulaC41H66O12
  • Average mass750.956 Da
  • Monoisotopic mass750.455444 Da
  • ChemSpider ID8072559

  • defined stereocentres - 16 of 16 defined stereocentres

More details:

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

(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}lanosta-8,24-dien-30-oic acid [ACD/IUPAC Name]
(3β)-3-{[2-O-(β-D-Galactopyranosyl)-α-L-arabinopyranosyl]oxy}lanosta-8,24-dien-30-säure [German] [ACD/IUPAC Name]
Acide (3β)-3-{[2-O-(β-D-galactopyranosyl)-α-L-arabinopyranosyl]oxy}lanosta-8,24-dién-30-oïque [French] [ACD/IUPAC Name]
Lanosta-8,24-dien-30-oic acid, 3-[(2-O-β-D-galactopyranosyl-α-L-arabinopyranosyl)oxy]-, (3β)- [ACD/Index Name]
(3S,5R,10S,13R,14S,17R)-3-((2S,3R,4S,5S)-4,5-dihydroxy-3-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)-tetrahydro-2H-pyran-2-yloxy)-4,4,10,13-tetramethyl-17-((R)-6-methylhept-5-en-2-yl)-2,3,4,5,6,7,10,11,12,13,14,15,16,
Eryloside F
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL374281/

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

Density: 1.3±0.1 g/cm3
Boiling Point: 853.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 141.0±6.0 kJ/mol
Flash Point: 251.1±27.8 °C
Index of Refraction: 1.592
Molar Refractivity: 196.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 7
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 4
ACD/LogP: 6.76
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 517.69
ACD/KOC (pH 5.5): 1580.55
ACD/LogD (pH 7.4): 2.39
ACD/BCF (pH 7.4): 8.14
ACD/KOC (pH 7.4): 24.85
Polar Surface Area: 196 Å2
Polarizability: 77.8±0.5 10-24cm3
Surface Tension: 61.5±5.0 dyne/cm
Molar Volume: 579.9±5.0 cm3

Click to predict properties on the Chemicalize site


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