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Search term: WQDDUOYIJXNUHJ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-O-(alpha-D-galactopyranosyl)-N-(10-phenyldecanoyl)phytosphingosine | C40H71NO9

1-O-(α-D-galactopyranosyl)-N-(10-phenyldecanoyl)phytosphingosine

  • Molecular FormulaC40H71NO9
  • Average mass709.993 Da
  • Monoisotopic mass709.512878 Da
  • ChemSpider ID23317160

  • defined stereocentres - 8 of 8 defined stereocentres

More details:

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

1-O-(α-D-galactopyranosyl)-N-(10-phenyldecanoyl)phytosphingosine
946607-29-0 [RN]
Benzenedecanamide, N-[(1S,2S,3R)-1-[(α-D-galactopyranosyloxy)methyl]-2,3-dihydroxyheptadecyl]- [ACD/Index Name]
N-[(2S,3S,4R)-1-(α-D-Galactopyranosyloxy)-3,4-dihydroxy-2-octadecanyl]-10-phenyldecanamid [German] [ACD/IUPAC Name]
N-[(2S,3S,4R)-1-(α-D-Galactopyranosyloxy)-3,4-dihydroxy-2-octadecanyl]-10-phenyldecanamide [ACD/IUPAC Name]
N-[(2S,3S,4R)-1-(α-D-Galactopyranosyloxy)-3,4-dihydroxy-2-octadécanyl]-10-phényldécanamide [French] [ACD/IUPAC Name]
N-[(2S,3S,4R)-1-(α-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]-10-phenyldecanamide
C10Ph
C1Q
N-((2S,3S,4R)-3,4-dihydroxy-1-((2S,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)-tetrahydro-2H-pyran-2-yloxy)octadecan-2-yl)-10-phenyldecanamide
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

18641306 [DBID]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 887.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 135.1±3.0 kJ/mol
Flash Point: 490.2±34.3 °C
Index of Refraction: 1.545
Molar Refractivity: 198.4±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 30
#Rule of 5 Violations: 4
ACD/LogP: 8.85
ACD/LogD (pH 5.5): 8.14
ACD/BCF (pH 5.5): 907696.31
ACD/KOC (pH 5.5): 640121.63
ACD/LogD (pH 7.4): 8.14
ACD/BCF (pH 7.4): 907689.38
ACD/KOC (pH 7.4): 640116.69
Polar Surface Area: 169 Å2
Polarizability: 78.7±0.5 10-24cm3
Surface Tension: 53.5±5.0 dyne/cm
Molar Volume: 627.2±5.0 cm3

Click to predict properties on the Chemicalize site


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