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CHEBI:147243 - β-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc

ChEBI IDCHEBI:147243
ChEBI Nameβ-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc
Stars
ASCII Namebeta-D-Galp-(1->3)-[beta-D-Galp3S-(1->4)-beta-D-GlcpNAc-(1->6)]-D-GalpNAc
DefinitionAn amino tetrasaccharide that is β-D-galactopyranosyl-(1→3)-2-acetamido-2-deoxy-D-galactopyranose in which the hydroxy group at position 6 f the acetamidogalactopyranose group has been glycosylated by a 2-acetamido-2-deoxy-4-O-(3-O-sulfo-β-D-galactopyranosyl)-β-D-glucopyranosyl group.
Last Modified4 May 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC28H48N2O24S
Net Charge0
Average Mass828.749
Monoisotopic Mass828.23177
SMILESCC(=O)N[C@H]1[C@H](OC[C@H]2OC(O)[C@H](NC(C)=O)[C@@H](O[C@@H]3O[C@H](CO)[C@H](O)[C@H](O)[C@H]3O)[C@H]2O)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
InChIInChI=1S/C28H48N2O24S/c1-7(34)29-13-18(39)22(52-28-21(42)24(54-55(44,45)46)16(37)10(4-32)50-28)11(5-33)51-26(13)47-6-12-17(38)23(14(25(43)48-12)30-8(2)35)53-27-20(41)19(40)15(36)9(3-31)49-27/h9-28,31-33,36-43H,3-6H2,1-2H3,(H,29,34)(H,30,35)(H,44,45,46)/t9-,10-,11-,12-,13-,14-,15+,16+,17+,18-,19+,20-,21-,22-,23-,24+,25?,26-,27+,28+/m1/s1
InChIKeyFWCAHCHAKICFIX-HIUYBGSYSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc (CHEBI:147243) is a acetamides (CHEBI:22160)
β-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc (CHEBI:147243) is a amino tetrasaccharide (CHEBI:59412)
β-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc (CHEBI:147243) is a oligosaccharide sulfate (CHEBI:37909)
Incoming Relation(s)
α-L-Fucp-(1→2)-β-D-Galp-(1→3)-[3-O-sulfo-β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc (CHEBI:146819) has functional parent β-D-Galp-(1→3)-[β-D-Galp3S-(1→4)-β-D-GlcpNAc-(1→6)]-D-GalpNAc (CHEBI:147243)
IUPAC Names 
Gal3S(b1-4)GlcNAc(b1-6)[Gal(b1-3)]GalNAc
β-D-galactopyranosyl-(1→3)-[3-O-sulfo-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→6)]-2-acetamido-2-deoxy-D-galactopyranose
Synonyms  Source
3-O-sulfo-β-D-galacto-hexopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-gluco-hexopyranosyl-(1→6)-[β-D-galacto-hexopyranosyl-(1→3)]-2-acetamido-2-deoxy-D-galacto-hexopyranoseIUPAC
[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-5-Acetamido-6-[[(2R,3R,4R,5R)-5-acetamido-3,6-dihydroxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]methoxy]-4-hydroxy-2-(hydroxymethyl)oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] hydrogen sulfateIUPAC
Manual XrefsDatabases
G10816YXGlyTouCan
G03172KEGG GLYCAN
G10816YXGlyGen