beta-D-Galp3S-(1->4)-[alpha-L-Fucp-(1->3)]-D-GlcpNAc (CHEBI:65176)

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CHEBI:65176 - β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc

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ChEBI ID	CHEBI:65176
ChEBI Name	β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc
Stars
ASCII Name	beta-D-Galp3S-(1->4)-[alpha-L-Fucp-(1->3)]-D-GlcpNAc
Definition	An amino trisaccharide that consists of N-acetyl-D-glucosamine having an α-L-fucosyl residue attached at position 3 and a 3-sulfated β-D-galactosyl residue attached at position 4.
Last Modified	10 April 2024
Submitter	Steve
Downloads	Molfile

Formula	C20H35NO18S
Net Charge	0
Average Mass	609.556
Monoisotopic Mass	609.15748
SMILES	CC(=O)N[C@H]1C(O)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](OS(=O)(=O)O)[C@H]2O)[C@@H]1O[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]1O
WURCS	WURCS=2.0/3,3,2/[a2122h-1x_1-5_2NCC/3=O][a1221m-1a_1-5][a2112h-1b_1-5_3OSO/3=O/3=O]/1-2-3/a3-b1_a4-c1
InChI	InChI=1S/C20H35NO18S/c1-5-10(25)12(27)13(28)19(34-5)38-16-9(21-6(2)24)18(30)35-8(4-23)15(16)37-20-14(29)17(39-40(31,32)33)11(26)7(3-22)36-20/h5,7-20,22-23,25-30H,3-4H2,1-2H3,(H,21,24)(H,31,32,33)/t5-,7+,8+,9+,10+,11-,12+,13-,14+,15+,16+,17-,18?,19-,20-/m0/s1
InChIKey	SQDFRWJUKVCUOT-KGGMAGTISA-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)]-D-GlcpNAc (CHEBI:65176) has role epitope (CHEBI:53000)
	β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc (CHEBI:65176) is a amino trisaccharide (CHEBI:59266)
	β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc (CHEBI:65176) is a oligosaccharide sulfate (CHEBI:37909)
Incoming Relation(s)
	β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcpNAc (CHEBI:65171) is a β-D-Galp3S-(1→4)-[α-L-Fucp-(1→3)]-D-GlcpNAc (CHEBI:65176)

IUPAC Name
α-L-fucopyranosyl-(1→3)-[3-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-D-glucopyranose

Synonyms	Source
β-D-Gal3S-(1→4)-[α-L-Fuc-(1→3)]-D-GlcNAc	ChEBI
α-L-fucosyl-(1→3)-[3-O-sulfo-β-D-galactosyl-(1→4)]-N-acetyl-D-glucosamine	ChEBI
6-deoxy-α-L-galactopyranosyl-(1→3)-[3-O-sulfo-β-D-galactopyranosyl-(1→4)]-2-acetamido-2-deoxy-D-glucopyranose	IUPAC
[3OSO3]Galβ1-4[Fucα1-3]GlcNAc	ChEBI
Lewis x-sulfated	KEGG GLYCAN
(Gal)1 (GlcNAc)1 (LFuc)1 (S)1	KEGG GLYCAN

Manual Xrefs	Databases
G01078	KEGG GLYCAN
JP2003235550	Patent
G26555CS	GlyTouCan
G26555CS	GlyGen

Registry Numbers	Sources
Reaxys:19308701	Reaxys

Citations