ChemSpider 2D Image | CIS-TETRACOSENOYL SULFATIDE | C48H91NO11S

CIS-TETRACOSENOYL SULFATIDE

  • Molecular FormulaC48H91NO11S
  • Average mass890.301 Da
  • Monoisotopic mass889.631287 Da
  • ChemSpider ID4573154

  • 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

(15Z)-N-[(1S,2R,3E)-2-Hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]-15-tetracosenamide
(15Z)-N-{(2S,3R,4E)-3-Hydroxy-1-[(3-O-sulfo-β-D-galactopyranosyl)oxy]-4-octadecen-2-yl}-15-tetracosenamid [German] [ACD/IUPAC Name]
(15Z)-N-{(2S,3R,4E)-3-Hydroxy-1-[(3-O-sulfo-β-D-galactopyranosyl)oxy]-4-octadecen-2-yl}-15-tetracosenamide [ACD/IUPAC Name]
(15Z)-N-{(2S,3R,4E)-3-Hydroxy-1-[(3-O-sulfo-β-D-galactopyranosyl)oxy]-4-octadécén-2-yl}-15-tétracosénamide [French] [ACD/IUPAC Name]
1-(3-O-sulfo-β-D-galactosyl)-N-[(15Z)-tetracos-15-enoyl]sphingosine
151057-28-2 [RN]
15-Tetracosenamide, N-[(1S,2R,3E)-2-hydroxy-1-[[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]-, (15Z)- [ACD/Index Name]
CIS-TETRACOSENOYL SULFATIDE
(15Z)-N-((1S,2R,3E)-2-HYDROXY-1-{[(3-O-SULFO-β-D-GALACTOPYRANOSYL)OXY]METHYL}HEPTADEC-3-ENYL)TETRACOS-15-ENAMIDE
(15Z)-N-[(1S,2R,3E)-2-hydroxy-1-{[(3-O-sulfo-β-D-galactopyranosyl)oxy]methyl}heptadec-3-en-1-yl]tetracos-15-enamide
More...
  • Miscellaneous

    • Chemical Class:

      An <element>N</element>-acyl-<stereo>beta</stereo>-<stereo>D</stereo>-galactosylsphingosine having a sulfo group at the 3-position on the galactose ring and (15<stereo>Z</stereo>)-tetracos-15-enoyl as the <element>N</element>-acyl group. ChEBI CHEBI:41539
      An N-acyl-beta-D-galactosylsphingosine having a sulfo group at the 3-position on the galactose ring and (15Z)-tetracos-15-enoyl as the N-acyl group. ChEBI CHEBI:41539
      An N-acyl-beta-D-galactosylsphingosine having a sulfo group at the 3-position on the galactose ring and (15Z)-tetracos-15-enoyl as; the N-acyl group. ChEBI https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:41539

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

Density: 1.1±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.526
Molar Refractivity: 247.4±0.4 cm3
#H bond acceptors: 12
#H bond donors: 6
#Freely Rotating Bonds: 42
#Rule of 5 Violations: 4
ACD/LogP: 17.18
ACD/LogD (pH 5.5): 10.16
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 204117.50
ACD/LogD (pH 7.4): 10.16
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 204114.14
Polar Surface Area: 200 Å2
Polarizability: 98.1±0.5 10-24cm3
Surface Tension: 49.9±5.0 dyne/cm
Molar Volume: 806.5±5.0 cm3

Click to predict properties on the Chemicalize site


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