CHEBI:72334 - 1-O-(α-D-galactopyranosyl)-N-pamitoylphytosphingosine

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ChEBI Name 1-O-(α-D-galactopyranosyl)-N-pamitoylphytosphingosine
ChEBI ID CHEBI:72334
ChEBI ASCII Name 1-O-(alpha-D-galactopyranosyl)-N-pamitoylphytosphingosine
Definition A glycophytoceramide having an α-D-galactopyranosyl residue at the O-1 position and a palmitoyl (hexadecanoyl) group attached to the nitrogen.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C40H79NO9
Net Charge 0
Average Mass 718.05660
Monoisotopic Mass 717.57548
InChI InChI=1S/C40H79NO9/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-35(44)41-32(31-49-40-39(48)38(47)37(46)34(30-42)50-40)36(45)33(43)28-26-24-22-20-18-16-14-12-10-8-6-4-2/h32-34,36-40,42-43,45-48H,3-31H2,1-2H3,(H,41,44)/t32-,33+,34+,36-,37-,38-,39+,40-/m0/s1
InChIKey HRAAKPGXJOTHIU-WVLAUNTOSA-N
SMILES CCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1O[C@H](CO)[C@H](O)[C@H](O)[C@H]1O)[C@H](O)[C@H](O)CCCCCCCCCCCCCC
Roles Classification
Biological Role(s): epitope
The biological role played by a material entity when bound by a receptor of the adaptive immune system. Specific site on an antigen to which an antibody binds.
mouse metabolite
Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
(via N-acylphytosphingosine )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 1-O-(α-D-galactopyranosyl)-N-pamitoylphytosphingosine (CHEBI:72334) has functional parent α-D-galactose (CHEBI:28061)
1-O-(α-D-galactopyranosyl)-N-pamitoylphytosphingosine (CHEBI:72334) has role epitope (CHEBI:53000)
1-O-(α-D-galactopyranosyl)-N-pamitoylphytosphingosine (CHEBI:72334) is a glycophytoceramide (CHEBI:59389)
IUPAC Name
N-[(2S,3S,4R)-1-(α-D-galactopyranosyloxy)-3,4-dihydroxyoctadecan-2-yl]hexadecanamide
Synonyms Sources
(2R,3S,4S)-1-O-(α-D-galactopyarnosyl)-2-palmitoylamino-1,3,4-octadecanetriol ChEBI
C16:0-αGalCer ChEBI
C16:0-αGalCer ChEBI
Manual Xrefs Databases
4F7E PDB
US52316 Patent
View more database links
Registry Number Type Source
9892881 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
23110152 PubMed citation Europe PMC
Last Modified
12 February 2013