sulfatide structure

sulfatide

[(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(E,2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadec-4-enoxy]oxan-4-yl] hydrogen sulfate

Also Known As: sulfatide|Sulfatides|3'-Sulfogalactosylceramide|Sulfoglycosphingolipids|Tetracosanoyl-sulfatide|tetracosanoyl sulfatide|Sulfatoglycosphingolipids|3' Sulfogalactosylceramide|Epitope ID:139424|3'-Sulfo-galactosylceramide|1,3-Dimethyl-4-ethylcarbostyril|3-O-Sulfogalactosylceramide (d18:1/24:0)|(3'-sulfo)Galbeta-Cer(d18:1/24:0)|C24 3'-sulfo Galactosylceramide (d18:1/24:0)|SID:123071348|1-(3-O-sulfo-beta-D-galactosyl)-N-tetracosanoylsphingosine|[(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(E,2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadec-4-enoxy]oxan-4-yl] hydrogen sulfate|1-(3-O-sulfo-|A-D-galactosyl)-N-tetracosanoylsphingosine|-3,5-dihydroxy-2- -6-[ -3-hydroxy-2- octadec-4-enoxy]-4-sulfooxy-oxane|-3,5-dihydroxy-2-6-[-3-hydroxy-2- octadec-4-enoxy]-4-sulfooxy-oxane|[(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(E,2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadec-4-enoxy]tetrahydropyran-4-yl] hydrogen sulfate|Tetracosanamide, N-((1S,2R,3E)-2-hydroxy-1-(((3-O-sulfo-beta-D-galactopyranosyl)oxy)methyl)-3-heptadecenyl)-|Tetracosanamide, N-[(1S,2R,3E)-2-hydroxy-1-[[(3-O-sulfo-beta-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]-|[ -3,5-dihydroxy-2- -6-[ -3-hydroxy-2- octadec-4-enoxy]oxan-4-yl]hydrogensulfate|(15Z)-N-((1S,2R,3E)-2-HYDROXY-1-{[(3-O-SULFO-BETA-D-GALACTOPYRANOSYL)OXY]METHYL}HEPTADEC-3-ENYL)TETRACOS-15-ENAMIDE|(2R,3R,4S,5S,6R)-3,5-Dihydroxy-2-(((2S,3R,E)-3-hydroxy-2-tetracosanamidooctadec-4-en-1-yl)oxy)-6-(hydroxymethyl)tetrahydro-2H-pyran-4-yl hydrogen sulfate|[(2R,3R,4S,5S,6R)-3,5-dihydroxy-2-{[(2S,3R,4E)-3-hydroxy-2-tetracosanamidooctadec-4-en-1-yl]oxy}-6-(hydroxymethyl)oxan-4-yl]oxidanesulfonic acid|CIS|N-((1S,2R,3E)-2-Hydroxy-1-(((3-O-sulfo-beta-D-galactopyranosyl)oxy)methyl)-3-heptadecen-1-yl)tetracosanamide|N-[(1S,2R,3E)-2-Hydroxy-1-[[(3-O-sulfo-I(2)-D-galactopyranosyl)oxy]methyl]-3-heptadecen-1-yl]tetracosanamide|N-{(2S,3R,4E)-3-hydroxy-1-[(3-O-sulfo-beta-D-galactopyranosyl)oxy]octadec-4-en-2-yl}tetracosanamide

CAS: 3688-74-2
Molecular Formula C48H93NO11S
Molecular Weight 891.6469 g/mol
LogP 10.3351
Topological Polar Surface Area 192.08 Ų
Hydrogen Bond Donors 6
Hydrogen Bond Acceptors 10
Rotatable Bonds 43
Exact Mass 891.6469
Monoisotopic Mass 891.6469
Heavy Atoms 61
Complexity 1142.7152

Chemical Identifiers

CAS Number 3688-74-2
SMILES CCCCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)OS(=O)(=O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O

Product Overview

sulfatide (CAS 3688-74-2), with molecular formula C48H93NO11S and molecular weight 891.6469 g/mol. IUPAC: [(2R,3S,4S,5R,6R)-3,5-dihydroxy-2-(hydroxymethyl)-6-[(E,2S,3R)-3-hydroxy-2-(tetracosanoylamino)octadec-4-enoxy]oxan-4-yl] hydrogen sulfate.

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