ChemSpider 2D Image | 16-[(6-O-Acetyl-beta-D-glucopyranosyl)oxy]-2,15-dihydroxyhexadecanoic acid | C24H44O11

16-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-2,15-dihydroxyhexadecanoic acid

  • Molecular FormulaC24H44O11
  • Average mass508.600 Da
  • Monoisotopic mass508.288361 Da
  • ChemSpider ID29355818

  • defined stereocentres - 5 of 7 defined stereocentres

More details:

Featured data source
Natural Product Updates

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

16-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-2,15-dihydroxyhexadecanoic acid [ACD/IUPAC Name]
16-[(6-O-Acetyl-β-D-glucopyranosyl)oxy]-2,15-dihydroxyhexadecansäure [German] [ACD/IUPAC Name]
Acide 16-[(6-O-acétyl-β-D-glucopyranosyl)oxy]-2,15-dihydroxyhexadécanoïque [French] [ACD/IUPAC Name]
Hexadecanoic acid, 16-[(6-O-acetyl-β-D-glucopyranosyl)oxy]-2,15-dihydroxy- [ACD/Index Name]
ustilagic acid A
Ustilagic acid C

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

Density: 1.3±0.1 g/cm3
Boiling Point: 706.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.1±6.0 kJ/mol
Flash Point: 229.5±26.4 °C
Index of Refraction: 1.535
Molar Refractivity: 125.6±0.4 cm3
#H bond acceptors: 11
#H bond donors: 6
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 3
ACD/LogP: 3.69
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.13
ACD/LogD (pH 7.4): -1.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 183 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 403.4±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement