Found 3 results

Search term: MF = 'C_{43}H_{83}NO_{9}'
ChemSpider 2D Image | (2R)-N-[(2S,3R,8E)-1-(beta-D-Glucopyranosyloxy)-3-hydroxy-9-methyl-8-henicosen-2-yl]-2-hydroxypentadecanamide | C43H83NO9

(2R)-N-[(2S,3R,8E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-9-methyl-8-henicosen-2-yl]-2-hydroxypentadecanamide

  • Molecular FormulaC43H83NO9
  • Average mass758.120 Da
  • Monoisotopic mass757.606812 Da
  • ChemSpider ID113381813

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 8 of 8 defined stereocentres

More details:

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

(2R)-N-[(2S,3R,8E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-9-methyl-8-henicosen-2-yl]-2-hydroxypentadecanamid [German] [ACD/IUPAC Name]
(2R)-N-[(2S,3R,8E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-9-methyl-8-henicosen-2-yl]-2-hydroxypentadecanamide [ACD/IUPAC Name]
(2R)-N-[(2S,3R,8E)-1-(β-D-Glucopyranosyloxy)-3-hydroxy-9-méthyl-8-hénicosén-2-yl]-2-hydroxypentadécanamide [French] [ACD/IUPAC Name]
Pentadecanamide, N-[(1S,2R,7E)-1-[(β-D-glucopyranosyloxy)methyl]-2-hydroxy-8-methyl-7-eicosen-1-yl]-2-hydroxy-, (2R)- [ACD/Index Name]
1-O-β-d-glucopyranosyl-(2R)-2-hydroxy-N-((E,2S,3R)-1,3-dihydroxy-9-methylhenicos-8-en-2-yl) pentadecanamide
GlcCer(d21:1(8E)(9Me)/15:0(2OH[R]))
N-(2R-hydroxypentadecanoyl)-1-β-glucosyl-9-methyl-8E-heneicosphingenine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 890.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 146.9±6.0 kJ/mol
Flash Point: 492.1±34.3 °C
Index of Refraction: 1.521
Molar Refractivity: 215.1±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 35
#Rule of 5 Violations: 4
ACD/LogP: 11.94
ACD/LogD (pH 5.5): 11.46
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.46
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 169 Å2
Polarizability: 85.3±0.5 10-24cm3
Surface Tension: 48.8±5.0 dyne/cm
Molar Volume: 706.6±5.0 cm3

Click to predict properties on the Chemicalize site


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