ChemSpider 2D Image | C8 Galactosylceramide (d18:1/8:0) | C32H61NO8

C8 Galactosylceramide (d18:1/8:0)

  • Molecular FormulaC32H61NO8
  • Average mass587.829 Da
  • Monoisotopic mass587.439697 Da
  • ChemSpider ID27471378

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 7 of 7 defined stereocentres

More details:

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

41613-16-5 [RN]
C8 Galactosylceramide (d18:1/8:0)
C8 β-D-galactosyl N-acylsphingosine
N-[(2S,3R,4E)-1-(β-D-Galactopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]octanamid [German] [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Galactopyranosyloxy)-3-hydroxy-4-octadecen-2-yl]octanamide [ACD/IUPAC Name]
N-[(2S,3R,4E)-1-(β-D-Galactopyranosyloxy)-3-hydroxy-4-octadécén-2-yl]octanamide [French] [ACD/IUPAC Name]
Octanamide, N-[(1S,2R,3E)-1-[(β-D-galactopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]- [ACD/Index Name]
C8 β-D-galactosylceramide
D-galactosyl--1,1' N-octanoyl-D-erythro-sphingosine
N-[(1S,2R,3E)-1-[(β-D-galactopyranosyloxy)methyl]-2-hydroxy-3-heptadecen-1-yl]-octanamide
More...

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

CHEBI:64109 [DBID]
  • Miscellaneous

    • Chemical Class:

      A <stereo>D</stereo>-galactosyl-<element>N</element>-acylsphingosine in which the glycosidic bond has <stereo>beta</stereo>-configuration and the ceramide <element>N</element>-acyl group is specified as octanoyl. ChEBI CHEBI:64109
      A D-galactosyl-N-acylsphingosine in which the glycosidic bond has beta-configuration and the ceramide N-acyl group is specified ; as octanoyl. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:64109
      A D-galactosyl-N-acylsphingosine in which the glycosidic bond has beta-configuration and the ceramide N-acyl group is specified as octanoyl. ChEBI CHEBI:64109

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

Density: 1.1±0.1 g/cm3
Boiling Point: 783.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±6.2 mmHg at 25°C
Enthalpy of Vaporization: 129.9±6.0 kJ/mol
Flash Point: 427.6±32.9 °C
Index of Refraction: 1.523
Molar Refractivity: 162.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 3
ACD/LogP: 6.97
ACD/LogD (pH 5.5): 7.00
ACD/BCF (pH 5.5): 122199.12
ACD/KOC (pH 5.5): 152370.67
ACD/LogD (pH 7.4): 7.00
ACD/BCF (pH 7.4): 122198.18
ACD/KOC (pH 7.4): 152369.50
Polar Surface Area: 149 Å2
Polarizability: 64.6±0.5 10-24cm3
Surface Tension: 49.8±5.0 dyne/cm
Molar Volume: 532.7±5.0 cm3

Click to predict properties on the Chemicalize site


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