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CHEBI:83877 - N-lignoceroyl-(3-O-sulfo-D-galactosyl)sphingosine(1−)

ChEBI IDCHEBI:83877
ChEBI NameN-lignoceroyl-(3-O-sulfo-D-galactosyl)sphingosine(1−)
Stars
ASCII NameN-lignoceroyl-(3-O-sulfo-D-galactosyl)sphingosine(1-)
DefinitionAn N-acyl-(3-O-sulfo-D-galactosyl)sphingosine(1−) obtained by deprotonation of the sulfo group of N-lignoceroyl-(3-O-sulfo-D-galactosyl)sphingosine; major species at pH 7.3.
Last Modified13 February 2015
Submitterlaimo
DownloadsMolfile
FormulaC48H92NO11S
Net Charge-1
Average Mass891.327
Monoisotopic Mass890.63966
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](COC1O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)[O-])[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C48H93NO11S/c1-3-5-7-9-11-13-15-17-18-19-20-21-22-23-24-26-28-30-32-34-36-38-44(52)49-41(42(51)37-35-33-31-29-27-25-16-14-12-10-8-6-4-2)40-58-48-46(54)47(60-61(55,56)57)45(53)43(39-50)59-48/h35,37,41-43,45-48,50-51,53-54H,3-34,36,38-40H2,1-2H3,(H,49,52)(H,55,56,57)/p-1/b37-35+/t41-,42+,43+,45-,46+,47-,48?/m0/s1
InChIKeyMEAZTWJVOWHKJM-MDLODANTSA-M
ChEBI Ontology
Outgoing Relation(s)
N-lignoceroyl-(3-O-sulfo-D-galactosyl)sphingosine(1−) (CHEBI:83877) is a N-acyl-(3-O-sulfo-D-galactosyl)sphingosine(1−) (CHEBI:83875)
IUPAC Name 
(2S,3R,4E)-3-hydroxy-2-(tetracosanoylamino)octadec-4-en-1-yl 3-O-sulfonato-D-galactopyranoside
Synonyms  Source
(3O-sulfo-D-galactosyl)-N-tetracosanoylsphing-4-enine(1−)SUBMITTER
C24 galactosylceramide sulfateSUBMITTER
UniProt Name  Source
N-(tetracosanoyl)-(3O-sulfo-D-galactosyl)-sphing-4-enineUniProt