ChemSpider 2D Image | 1-(3-O-sulfo-beta-D-galactosyl)sphingosine | C24H47NO10S

1-(3-O-sulfo-β-D-galactosyl)sphingosine

  • Molecular FormulaC24H47NO10S
  • Average mass541.696 Da
  • Monoisotopic mass541.292053 Da
  • ChemSpider ID5022880

  • 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

(2S,3R,4E)-2-Amino-3-hydroxy-4-octadecen-1-yl 3-O-sulfo-β-D-galactopyranoside [ACD/IUPAC Name]
(2S,3R,4E)-2-Amino-3-hydroxy-4-octadecen-1-yl-3-O-sulfo-β-D-galactopyranosid [German] [ACD/IUPAC Name]
1-(3-O-sulfo-β-D-galactosyl)sphingosine
3-O-Sulfo-β-D-galactopyranoside de (2S,3R,4E)-2-amino-3-hydroxy-4-octadécén-1-yle [French] [ACD/IUPAC Name]
β-D-Galactopyranoside, (2S,3R,4E)-2-amino-3-hydroxy-4-octadecen-1-yl, 3-(hydrogen sulfate) [ACD/Index Name]
(2S,3R,4E)-2-amino-3-hydroxyoctadec-4-en-1-yl 3-O-sulfo-β-D-galactopyranoside
Lysosulfatide
Lyso-sulfatide
lysosulphatide
N-deacylated galactosylceramide sulfate
More...

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

8814990 [DBID]
  • Miscellaneous

    • Chemical Class:

      A sulfoglycosphingolipid that is sphingosine substituted on O-1 by a 3-<element>O</element>-sulfo-<stereo>beta</stereo>-<stereo>D</stereo>-galactosyl group. ChEBI CHEBI:60372
      A sulfoglycosphingolipid that is sphingosine substituted on O-1 by a 3-O-sulfo-beta-D-galactosyl group; sulfatide in which one acyl chain has been ; removed by ozonolysis. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:60372
      A sulfoglycosphingolipid that is sphingosine substituted on O-1 by a 3-O-sulfo-beta-D-galactosyl group; sulfatide in which one acyl chain has been removed by ozonolysis. ChEBI CHEBI:60372

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.549
Molar Refractivity: 136.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 7
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 4
ACD/LogP: 6.44
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.23
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.15
Polar Surface Area: 197 Å2
Polarizability: 54.0±0.5 10-24cm3
Surface Tension: 59.8±5.0 dyne/cm
Molar Volume: 428.2±5.0 cm3

Click to predict properties on the Chemicalize site


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