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CHEBI:84722 - β-D-galactosyl-N-eicosanoylsphingosine

ChEBI IDCHEBI:84722
ChEBI Nameβ-D-galactosyl-N-eicosanoylsphingosine
Stars
ASCII Namebeta-D-galactosyl-N-eicosanoylsphingosine
DefinitionA β-D-galactosyl-N-acylsphingosine in which the acyl group is specified as eicosanoyl.
Last Modified5 February 2015
Submitternamrata
DownloadsMolfile
FormulaC44H85NO8
Net Charge0
Average Mass756.163
Monoisotopic Mass755.62752
SMILESCCCCCCCCCCCCC/C=C/[C@@H](O)[C@H](CO[C@@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)NC(=O)CCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C44H85NO8/c1-3-5-7-9-11-13-15-17-18-19-20-22-24-26-28-30-32-34-40(48)45-37(36-52-44-43(51)42(50)41(49)39(35-46)53-44)38(47)33-31-29-27-25-23-21-16-14-12-10-8-6-4-2/h31,33,37-39,41-44,46-47,49-51H,3-30,32,34-36H2,1-2H3,(H,45,48)/b33-31+/t37-,38+,39+,41-,42-,43+,44+/m0/s1
InChIKeyDFELABABMXOKTD-PWUIYKNCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - MetaboLights (MTBLS143)
Roles Classification
Biological Roles:
mouse metabolite  Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
β-D-galactosyl-N-eicosanoylsphingosine (CHEBI:84722) has functional parent icosanoic acid (CHEBI:28822)
β-D-galactosyl-N-eicosanoylsphingosine (CHEBI:84722) has role mouse metabolite (CHEBI:75771)
β-D-galactosyl-N-eicosanoylsphingosine (CHEBI:84722) is a N-acyl-β-D-galactosylsphingosine (CHEBI:18390)
IUPAC Name 
N-[(2S,3R,4E)-1-(β-D-galactopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]icosanamide
Synonyms  Source
GalCer(d18:1/20:0)LIPID MAPS
Galβ-Cer(d18:1/20:0)LIPID MAPS
Manual XrefsDatabases
LMSP0501AC03LIPID MAPS