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CHEBI:75965 - 1-(β-D-galactosyl)-N-[(2R)-2-hydroxybehenoyl]sphingosine

ChEBI IDCHEBI:75965
ChEBI Name1-(β-D-galactosyl)-N-[(2R)-2-hydroxybehenoyl]sphingosine
Stars
ASCII Name1-(beta-D-galactosyl)-N-[(2R)-2-hydroxybehenoyl]sphingosine
DefinitionA D-galactosyl-N-acylsphingosine in which the ceramide N-acyl group is specified as (R)-2-hydroxybehenoyl.
Last Modified25 October 2013
Submitterlaimo
DownloadsMolfile
FormulaC46H89NO9
Net Charge0
Average Mass800.216
Monoisotopic Mass799.65373
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)[C@H](O)CCCCCCCCCCCCCCCCCCCC
InChIInChI=1S/C46H89NO9/c1-3-5-7-9-11-13-15-17-18-19-20-21-23-25-27-29-31-33-35-40(50)45(54)47-38(37-55-46-44(53)43(52)42(51)41(36-48)56-46)39(49)34-32-30-28-26-24-22-16-14-12-10-8-6-4-2/h32,34,38-44,46,48-53H,3-31,33,35-37H2,1-2H3,(H,47,54)/b34-32+/t38-,39+,40+,41+,42-,43-,44+,46+/m0/s1
InChIKeyKYIWQDXUFOGPKU-PBEGBASASA-N
Roles Classification
Biological Role:
human metabolite  Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens).
ChEBI Ontology
Outgoing Relation(s)
1-(β-D-galactosyl)-N-[(2R)-2-hydroxybehenoyl]sphingosine (CHEBI:75965) has functional parent docosanoic acid (CHEBI:28941)
1-(β-D-galactosyl)-N-[(2R)-2-hydroxybehenoyl]sphingosine (CHEBI:75965) is a N-acyl-β-D-galactosylsphingosine (CHEBI:18390)
IUPAC Name 
(2R)-N-[(2S,3R,4E)-1-(β-D-galactopyranosyloxy)-3-hydroxyoctadec-4-en-2-yl]-2-hydroxydocosanamide
Synonym  Source
2-hydroxydocosanoylgalactosylceramideSUBMITTER
UniProt Name  Source
1-(D-galactosyl)-N-(2R)-2-hydroxy-docosanoylsphingosineUniProt