CHEBI:68608 - β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc
ChEBI ID CHEBI:68608
ChEBI ASCII Name beta-D-Galp-(1->3)-{alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcNAc-(1->6)}-D-GalNAc
Definition A branched amino hexasaccharide comprising a linear tetrasaccharide chain consisting of α-neuraminic acid, β-D-galactose, N-acetyl-D-glucosamine, and N-acetyl-D-galactosamine residues, linked sequentially (2→3), (1→4), and (1→6), with an α-L-fucosyl residue linked (1→3) to the N-acetyl-D-glucosamine residue and a D-galactose residue linked (1→3) to the reducing-end N-acetyl-D-glucosamine residue.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
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Formula C45H75N3O33
Net Charge 0
Average Mass 1186.07730
Monoisotopic Mass 1185.42828
InChI InChI=1S/C45H75N3O33/c1-11-24(58)29(63)31(65)41(72-11)79-37-23(48-14(4)55)40(71-10-20-28(62)35(22(39(68)73-20)47-13(3)54)78-42-32(66)30(64)26(60)17(7-50)74-42)76-19(9-52)34(37)77-43-33(67)38(27(61)18(8-51)75-43)81-45(44(69)70)5-15(56)21(46-12(2)53)36(80-45)25(59)16(57)6-49/h11,15-43,49-52,56-68H,5-10H2,1-4H3,(H,46,53)(H,47,54)(H,48,55)(H,69,70)/t11-,15-,16+,17+,18+,19+,20+,21+,22+,23+,24+,25+,26-,27-,28-,29+,30-,31-,32+,33+,34+,35+,36+,37+,38-,39?,40+,41-,42-,43-,45-/m0/s1
InChIKey NFMNIRJTVILQPB-KSGVFWEVSA-N
SMILES [H][C@]1(O[C@@](C[C@H](O)[C@H]1NC(C)=O)(O[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]2[C@@H](CO)O[C@@H](OC[C@H]3OC(O)[C@H](NC(C)=O)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3O)[C@H](NC(C)=O)[C@H]2O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@@H]1O)C(O)=O)[C@H](O)[C@H](O)CO
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.
(via beta-D-Galp-(1->3)-{alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-[alpha-L-Fucp-(1->3)]-beta-D-GlcNAc-(1->6)}-D-GalNAc )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608) has role epitope (CHEBI:53000)
β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608) is a N-acetylneuraminic acids (CHEBI:21622)
β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608) is a amino hexasaccharide (CHEBI:61855)
β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608) is a galactosamine oligosaccharide (CHEBI:22484)
β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608) is a glucosamine oligosaccharide (CHEBI:22485)
Incoming β-D-Gal-(1→3)-{α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc-(1→6)}-α-D-GalNAc (CHEBI:146205) is a β-D-Galp-(1→3)-{α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc (CHEBI:68608)
IUPAC Names
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosonyl-(2→3)-β-D-galactopyranosyl-(1→4)-[6-deoxy-α-L-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-[β-D-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-D-galactopyranose
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranosonyl-(2→3)-β-D-galactopyranosyl-(1→4)-[α-L-fucopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-[β-D-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-D-galactopyranose
Synonyms Sources
β-D-Gal-(1→3)-{α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc-(1→6)}-D-GalNAc ChEBI
Galβ1-3(Neu5Acα2-3Galβ1-4(Fucα1-3)GlcNAcβ1-6)GalNAc ChEBI
N-acetyl-α-neuraminosyl-(2→3)-β-D-galactosyl-(1→4)-[α-L-fucosyl-(1→3)]-N-acetyl-β-D-glucosaminyl-(1→6)-[β-D-galactosyl-(1→3)]-N-acetyl-D-galactosamine ChEBI
WURCS=2.0/5,6,5/[a2112h-1x_1-5_2*NCC/3=O][a2112h-1b_1-5][a2122h-1b_1-5_2*NCC/3=O][a1221m-1a_1-5][Aad21122h-2a_2-6_5*NCC/3=O]/1-2-3-4-2-5/a3-b1_a6-c1_c3-d1_c4-e1_e3-f2 GlyTouCan
Manual Xrefs Databases
G29014XV GlyTouCan
G29014XV GlyGen
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Citation Waiting for Citations Type Source
19443021 PubMed citation Europe PMC
Last Modified
13 April 2021