ChemSpider 2D Image | N-STEAROYLSPHINGOMYELIN | C41H83N2O6P

N-STEAROYLSPHINGOMYELIN

  • Molecular FormulaC41H83N2O6P
  • Average mass731.081 Da
  • Monoisotopic mass730.598877 Da
  • ChemSpider ID4510274

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-3-Hydroxy-2-(stearoylamino)-4-octadecen-1-yl 2-(trimethylammonio)ethyl phosphate [ACD/IUPAC Name]
(4E)-3-Hydroxy-2-(stearoylamino)-4-octadecen-1-yl-2-(trimethylammonio)ethylphosphat [German] [ACD/IUPAC Name]
54336-69-5 [RN]
C18 Sphingomyelin (d18:1/18:0)
Ethanaminium, 2-[[hydroxy[[(4E)-3-hydroxy-2-[(1-oxooctadecyl)amino]-4-octadecen-1-yl]oxy]phosphinyl]oxy]-N,N,N-trimethyl-, inner salt [ACD/Index Name]
N-STEAROYLSPHINGOMYELIN
Phosphate de (4E)-3-hydroxy-2-(stearoylamino)-4-octadécén-1-yle et de 2-(triméthylammonio)éthyle [French] [ACD/IUPAC Name]
[(E)-3-Hydroxy-2-(octadecanoylamino)octadec-4-enyl] 2-(trimethylazaniumyl)ethyl phosphate
4-hydroxy-7-(1-hydroxy-2-hexadecen-1-yl)-N,N,N-trimethyl-9-oxo-3,5-dioxa-8-aza-4-phosphahexacosan-1-aminium, 4-oxide, inner salt
4-hydroxy-7-(1-hydroxy-2-hexadecen-1-yl)-N,N,N-trimethyl-9-oxo-3,5-dioxa-8-aza-4-phosphahexacosan-1-aminium,4-oxide,innersalt
More...

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

05UG6280NI [DBID]

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

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 38
#Rule of 5 Violations: 2
ACD/LogP: 10.59
ACD/LogD (pH 5.5): 9.12
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 4088910.00
ACD/LogD (pH 7.4): 9.12
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 4089049.25
Polar Surface Area: 118 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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