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CHEBI:148172 - β-D-Galp-(1→3)-β-D-GlcNAcp-(1→6)-β-D-Galp-(1→4)-β-D-GlcNAcp

ChEBI IDCHEBI:148172
ChEBI Nameβ-D-Galp-(1→3)-β-D-GlcNAcp-(1→6)-β-D-Galp-(1→4)-β-D-GlcNAcp
Stars
ASCII Namebeta-D-Galp-(1->3)-beta-D-GlcNAcp-(1->6)-beta-D-Galp-(1->4)-beta-D-GlcNAcp
DefinitionAn amino tetrasaccharide comprised of a linear sequence of β-D-galactose, N-acetyl-β-D-glucosamine, β-D-galactose and N-acetyl-β-D-glucosamine residues linked (1→3), (1→6) and (1→4).
Last Modified30 June 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC28H48N2O21
Net Charge0
Average Mass748.685
Monoisotopic Mass748.27496
SMILESCC(=O)N[C@@H]1[C@@H](O)[C@H](O[C@@H]2O[C@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O[C@@H]4O[C@H](CO)[C@H](O)[C@H](O)[C@H]4O)[C@H]3NC(C)=O)[C@H](O)[C@H](O)[C@H]2O)[C@@H](CO)O[C@H]1O
WURCSWURCS=2.0/2,4,3/[a2122h-1b_1-5_2*NCC/3=O][a2112h-1b_1-5]/1-2-1-2/a4-b1_b6-c1_c3-d1
InChIInChI=1S/C28H48N2O21/c1-7(34)29-13-18(39)23(11(5-33)46-25(13)44)50-28-22(43)20(41)16(37)12(49-28)6-45-26-14(30-8(2)35)24(17(38)10(4-32)47-26)51-27-21(42)19(40)15(36)9(3-31)48-27/h9-28,31-33,36-44H,3-6H2,1-2H3,(H,29,34)(H,30,35)/t9-,10-,11-,12-,13-,14-,15+,16+,17-,18-,19+,20+,21-,22-,23-,24-,25-,26-,27+,28+/m1/s1
InChIKeyXEEVSXURZCKBBQ-AVDRWFNSSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp-(1→3)-β-D-GlcNAcp-(1→6)-β-D-Galp-(1→4)-β-D-GlcNAcp (CHEBI:148172) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Name 
β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
Gal(b1-3)GlcNAc(b1-6)Gal(b1-4)b-GlcNAcSUBMITTER
beta-D-galacto-hexopyranosyl-(1→3)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranosyl-(1→6)-beta-D-galacto-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-beta-D-gluco-hexopyranoseSUBMITTER
N-[(2R,3R,4R,5S,6R)-5-[(2S,3R,4S,5R,6R)-6-[[(2R,3R,4R,5S,6R)-3-Acetamido-5-hydroxy-6-(hydroxymethyl)-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxymethyl]-3,4,5-trihydroxyoxan-2-yl]oxy-2,4-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideChEBI
Galb1-3GlcNAcb1-6Galb1-4GlcNAcbChEBI
Galβ1-3GlcNAcβ1-6Galβ1-4GlcNAcβChEBI
Manual XrefsDatabases
G13626XXGlyTouCan
G13626XXGlyGen
Citations