ChemSpider 2D Image | (2S,3R,4E)-2-(Hexacosanoylamino)-3-hydroxy-4-octadecen-1-yl phosphatato(2-) | C44H86NO6P

(2S,3R,4E)-2-(Hexacosanoylamino)-3-hydroxy-4-octadecen-1-yl phosphatato(2-)

  • Molecular FormulaC44H86NO6P
  • Average mass756.132 Da
  • Monoisotopic mass755.620361 Da
  • ChemSpider ID28639165

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S,3R,4E)-2-(Hexacosanoylamino)-3-hydroxy-4-octadecen-1-yl phosphatato(2-) [ACD/IUPAC Name]
(2S,3R,4E)-2-(Hexacosanoylamino)-3-hydroxy-4-octadecen-1-ylphosphat [German] [ACD/IUPAC Name]
Hexacosanamidato(2-), N-[(1S,2R,3E)-2-hydroxy-1-[(phosphonooxy)methyl]-3-heptadecen-1-yl]-, ion(2-) [ACD/Index Name]
Phosphate de (2S,3R,4E)-2-(hexacosanoylamino)-3-hydroxy-4-octadécén-1-yle [French] [ACD/IUPAC Name]
(2S,3R,4E)-2-(hexacosanoylamino)-3-hydroxyoctadec-4-en-1-yl phosphate
CerP(d18:1/26:0)
N-(hexacosanoyl)sphing-4-enine-1-phosphate
N-hexacosanoylsphing-4-enine-1-phosphate
N-hexacosanoylsphingosine 1-phosphate(2-)
  • Miscellaneous

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: 7
#H bond donors: 4
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 2
ACD/LogP: 17.64
ACD/LogD (pH 5.5): 12.00
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2405282.00
ACD/LogD (pH 7.4): 11.07
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 278340.09
Polar Surface Area: 132 Å2
Polarizability:
Surface Tension:
Molar Volume:

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