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CHEBI:156097 - α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[β-D-Galp-(1→4)-β-D-Glcp-(1→6)]-β-D-GlcpNAc

ChEBI IDCHEBI:156097
ChEBI Nameα-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[β-D-Galp-(1→4)-β-D-Glcp-(1→6)]-β-D-GlcpNAc
Stars
ASCII Namealpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-[beta-D-Galp-(1->4)-beta-D-Glcp-(1->6)]-beta-D-GlcpNAc
DefinitionA branched amino pentasaccharide comprising the linear sequence α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-β-D-GlcNAc, to the terminal GlcNAc residue is attached at the 6-position a β-D-Gal-(1→4)-β-D-Glc disaccharide side-branch.
Last Modified10 July 2020
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC37H62N2O29
Net Charge0
Average Mass998.888
Monoisotopic Mass998.34382
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]3CO[C@@H]3O[C@H](CO)[C@@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H](O)[C@H]3O)[C@@H]2O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C37H62N2O29/c1-9(44)38-17-11(46)3-37(36(58)59,67-30(17)19(48)12(47)4-40)68-31-21(50)14(6-42)63-35(27(31)56)66-29-16(61-32(57)18(22(29)51)39-10(2)45)8-60-33-26(55)24(53)28(15(7-43)64-33)65-34-25(54)23(52)20(49)13(5-41)62-34/h11-35,40-43,46-57H,3-8H2,1-2H3,(H,38,44)(H,39,45)(H,58,59)/t11-,12+,13+,14+,15+,16+,17+,18+,19+,20-,21-,22+,23-,24+,25+,26+,27+,28+,29+,30+,31-,32+,33+,34-,35-,37-/m0/s1
InChIKeyRBOSUCYXSDXWBL-HCQXARLWSA-N
ChEBI Ontology
Outgoing Relation(s)
α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[β-D-Galp-(1→4)-β-D-Glcp-(1→6)]-β-D-GlcpNAc (CHEBI:156097) is a amino pentasaccharide (CHEBI:59268)
α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-[β-D-Galp-(1→4)-β-D-Glcp-(1→6)]-β-D-GlcpNAc (CHEBI:156097) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→3)-β-D-galactopyranosyl-(1→4)-[β-D-galactopyranosyl-(1→4)-β-D-glucopyranosyl-(1→6)]-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
Group B Streptococcus Type III Pentasaccharide (Branched frameshift)ChEBI
5-acetamido-3,5-dideoxy-D-glycero-α-D-galacto-non-2-ulonosyl-(2→3)-β-D-galactosyl-(1→4)-[β-D-galactosyl-(1→4)-β-D-glucosyl-(1→6)]-2-acetamido-2-deoxy-β-D-glucoseChEBI
Neu5Acα2-3Galβ1-4(GalβGlc1-4β1-6)GlcNAcβChEBI
α-Neu5Ac-(2→3)-β-D-Gal-(1→4)-[β-D-Gal-(1→4)-β-D-Glc-(1→6)]-β-D-GlcNAcChEBI
N-acetyl-α-neuraminyl-(2→3)-β-D-galactosyl-(1→4)-[β-D-galactosyl-(1→4)-β-D-glucosyl-(1→6)]-N-acetyl-β-D-glucosamineChEBI
Citations