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CHEBI:85947 - β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcpNAc6S

Default Structure
ChEBI IDCHEBI:85947
ChEBI Nameβ-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcpNAc6S
Stars
ASCII Namebeta-D-Galp3S-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcpNAc6S
Definitionβ-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc6S in which the anomeric configuration of the 6-O-sulfo-N-acetyl-D-glucosamine residue at the reducing end is β.
Last Modified27 June 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC20H35NO21S2
Net Charge0
Average Mass689.620
Monoisotopic Mass689.11430
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@@H](COS(=O)(=O)O)O[C@H]1O
InChIInChI=1S/C20H35NO21S2/c1-5-10(24)12(26)13(27)19(37-5)41-16-9(21-6(2)23)18(29)38-8(4-36-43(30,31)32)15(16)40-20-14(28)17(42-44(33,34)35)11(25)7(3-22)39-20/h5,7-20,22,24-29H,3-4H2,1-2H3,(H,21,23)(H,30,31,32)(H,33,34,35)/t5-,7+,8+,9+,10+,11-,12+,13-,14+,15+,16+,17-,18+,19-,20-/m0/s1
InChIKeyQIUAWXQXJLOJLR-JGMUFZQJSA-N
Roles Classification
Biological Role:
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.
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcpNAc6S (CHEBI:85947) is a β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc6S (CHEBI:65175)
IUPAC Names 
6-deoxy-α-L-galactopyranosyl-(1→3)-[3-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-6-O-sulfo-β-D-glucopyranose
α-L-fucopyranosyl-(1→3)-[3-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-6-O-sulfo-β-D-glucopyranose
Synonyms  Source
(3S)Galβ1-4(Fucα1-3)(6S)GlcNAcβChEBI
[3OSO3]Galβ1-4[Fucα1-3][6OSO3]GlcβNAcChEBI
(3S)Galb1-4(Fuca1-3)(6S)GlcNAcbChEBI
, O-6-deoxy-α-L-galactopyranosyl-(1→3)-O-[3-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-(acetylamino)-2-deoxy-β-D-glucopyranose, 6-(hydrogen sulfate)ChEBI
α-L-fucosyl-(1→3)-[3-O-sulfo-β-D-galactosyl-(1→4)]-6-O-sulfo-N-acetyl-β-D-glucosamineChEBI
β-D-Gal3S-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc6SChEBI
Citations