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CHEBI:155770 - β-D-GalpNAc-(1→3)-α-D-Galp-(1→6)-β-D-Galp-(1→4)-β-D-Glcp

ChEBI IDCHEBI:155770
ChEBI Nameβ-D-GalpNAc-(1→3)-α-D-Galp-(1→6)-β-D-Galp-(1→4)-β-D-Glcp
Stars
ASCII Namebeta-D-GalpNAc-(1->3)-alpha-D-Galp-(1->6)-beta-D-Galp-(1->4)-beta-D-Glcp
DefinitionAn amino tetrasaccharide comprised of a linear sequence of N-acetyl-β-D-galactosamine, α-D-galactose, β-D-galactose and β-D-glucose residues linked (1→3), (1→6) and (1→4).
Last Modified30 June 2020
SubmitterGareth Owen
DownloadsMolfile
FormulaC26H45NO21
Net Charge0
Average Mass707.632
Monoisotopic Mass707.24841
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@@H](O)[C@@H](CO)O[C@H](OC[C@H]3O[C@@H](O[C@H]4[C@H](O)[C@@H](O)[C@H](O)O[C@@H]4CO)[C@H](O)[C@@H](O)[C@H]3O)[C@@H]2O)O[C@H](CO)[C@H](O)[C@@H]1O
WURCSWURCS=2.0/4,4,3/[a2122h-1b_1-5][a2112h-1b_1-5][a2112h-1a_1-5][a2112h-1b_1-5_2*NCC/3=O]/1-2-3-4/a4-b1_b6-c1_c3-d1
InChIInChI=1S/C26H45NO21/c1-6(31)27-11-15(35)12(32)7(2-28)44-24(11)48-22-14(34)8(3-29)45-25(20(22)40)42-5-10-13(33)16(36)19(39)26(46-10)47-21-9(4-30)43-23(41)18(38)17(21)37/h7-26,28-30,32-41H,2-5H2,1H3,(H,27,31)/t7-,8-,9-,10-,11-,12+,13+,14+,15-,16+,17-,18-,19-,20-,21-,22+,23-,24+,25+,26+/m1/s1
InChIKeyXGDCRDQMOGAORK-VPMHXHSWSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GalpNAc-(1→3)-α-D-Galp-(1→6)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:155770) is a amino tetrasaccharide (CHEBI:59412)
β-D-GalpNAc-(1→3)-α-D-Galp-(1→6)-β-D-Galp-(1→4)-β-D-Glcp (CHEBI:155770) is a oligosaccharide (CHEBI:50699)
IUPAC Name 
2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→3)-α-D-galactopyranosyl-(1→6)-β-D-galactopyranosyl-(1→4)-β-D-glucopyranose
Synonyms  Source
GalNAc(b1-3)Gal(a1-6)Gal(b1-4)b-GlcSUBMITTER
2-acetamido-2-deoxy-beta-D-galacto-hexopyranosyl-(1→3)-alpha-D-galacto-hexopyranosyl-(1→6)-beta-D-galacto-hexopyranosyl-(1→4)-beta-D-gluco-hexopyranoseSUBMITTER
β-D-GalNAc-(1→3)-α-D-Gal-(1→6)-β-D-Gal-(1→4)-β-D-GalChEBI
GalNAcβ1-3Galα1-6Galβ1-4GlcβChEBI
N-[(2S,3R,4R,5R,6R)-2-[(2R,3S,4S,5R,6S)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[[(2R,3R,4S,5R,6S)-3,4,5-trihydroxy-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-2-yl]methoxy]oxan-4-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]acetamideChEBI
GalNAcb1-3Gala1-6Galb1-4GlcbChEBI
Manual XrefsDatabases
G94173VCGlyTouCan
G94173VCGlyGen
Citations