Found 16 results

Search term: MF = 'C_{43}H_{76}O_{10}'
ChemSpider 2D Image | (2S)-1-(beta-D-Galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate | C43H76O10

(2S)-1-(β-D-Galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate

  • Molecular FormulaC43H76O10
  • Average mass753.057 Da
  • Monoisotopic mass752.543823 Da
  • ChemSpider ID113374855

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 6 of 6 defined stereocentres

More details:

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

(2S)-1-(β-D-Galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyl (9Z,12Z,15Z)-9,12,15-octadecatrienoate [ACD/IUPAC Name]
(2S)-1-(β-D-Galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyl-(9Z,12Z,15Z)-9,12,15-octadecatrienoat [German] [ACD/IUPAC Name]
(9Z,12Z,15Z)-9,12,15-Octadécatriénoate de (2S)-1-(β-D-galactopyranosyloxy)-3-(palmitoyloxy)-2-propanyle [French] [ACD/IUPAC Name]
9,12,15-Octadecatrienoic acid, (1S)-2-(β-D-galactopyranosyloxy)-1-[[(1-oxohexadecyl)oxy]methyl]ethyl ester, (9Z,12Z,15Z)- [ACD/Index Name]
1-hexadecanoyl-2-(9Z-octadecenoyl)-3-O-β-D-galactosyl-sn-glycerol
MGDG(16:0/18:3(9Z,12Z,15Z))
Monogalactosyldiacylglycerol(16:0/18:3)

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

Density: 1.1±0.1 g/cm3
Boiling Point: 809.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.6 mmHg at 25°C
Enthalpy of Vaporization: 134.0±6.0 kJ/mol
Flash Point: 226.6±27.8 °C
Index of Refraction: 1.519
Molar Refractivity: 212.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 36
#Rule of 5 Violations: 3
ACD/LogP: 11.92
ACD/LogD (pH 5.5): 10.60
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 10.60
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 152 Å2
Polarizability: 84.1±0.5 10-24cm3
Surface Tension: 47.4±5.0 dyne/cm
Molar Volume: 698.9±5.0 cm3

Click to predict properties on the Chemicalize site


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