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CHEBI:139426 - β-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAc

ChEBI IDCHEBI:139426
ChEBI Nameβ-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAc
Stars
ASCII Namebeta-D-Galp-(1->4)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->3)-[alpha-Neup5Gc-(2->3)-beta-D-Galp-(1->4)-beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->3)-{alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->6)]-alpha-D-Manp-(1->6)}-beta-D-Manp-(1->4)-beta-D-GlcpNAc-(1->4)-beta-D-GlcpNAc
DefinitionAn amino oligosaccharide that is a branched pentadecasaccharide derivative comprising N-glycoloylneuraminic acid, D-galactose, N-acetyl-D-glucosamine and D-mannoseD residues linked as shown. It constitutes the N-glycan moiety in bovine thyroglobulin.
Last Modified16 January 2018
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC103H171N5O80
Net Charge0
Average Mass2759.456
Monoisotopic Mass2757.94662
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@@H]2[C@H](O)[C@@H](O)[C@H](O[C@H]3[C@H](O)[C@@H](NC(C)=O)[C@H](O[C@@H]4[C@@H](OC[C@H]5O[C@H](O[C@@H]6[C@H](O)[C@H](O[C@H]7[C@H](O)[C@@H](NC(C)=O)[C@H](O[C@H]8[C@H](O)[C@@H](NC(C)=O)[C@H](O)O[C@@H]8CO)O[C@@H]7CO)O[C@H](CO[C@H]7O[C@H](CO[C@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]8O)[C@@H](O)[C@H](O[C@H]8O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]8O)[C@@H]7O)[C@H]6O)[C@@H](O)[C@@H](O[C@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]6O[C@@H]6O[C@H](CO)[C@@H](O[C@@H]7O[C@H](CO)[C@H](O[C@@H]8O[C@H](CO)[C@H](O)[C@H](O)[C@H]8O)[C@H](O)[C@H]7O)[C@H](O)[C@H]6NC(C)=O)[C@@H]5O)O[C@H](CO)[C@@H](O)[C@@H]4O)O[C@@H]3CO)O[C@@H]2CO)(C(=O)O)C[C@H](O)[C@H]1NC(=O)CO
InChIInChI=1S/C103H171N5O80/c1-22(122)104-44-57(138)76(33(12-115)163-88(44)157)177-89-45(105-23(2)123)58(139)79(36(15-118)169-89)180-98-74(155)84(55(136)40(175-98)20-161-93-73(154)83(182-95-70(151)63(144)51(132)30(9-112)166-95)54(135)39(174-93)19-160-92-68(149)61(142)49(130)28(7-110)164-92)183-99-75(156)85(184-101-87(65(146)53(134)32(11-114)168-101)186-91-47(107-25(4)125)60(141)77(35(14-117)171-91)178-96-71(152)66(147)80(37(16-119)172-96)181-94-69(150)62(143)50(131)29(8-111)165-94)56(137)41(176-99)21-162-100-86(64(145)52(133)31(10-113)167-100)185-90-46(106-24(3)124)59(140)78(34(13-116)170-90)179-97-72(153)67(148)81(38(17-120)173-97)187-103(102(158)159)5-26(126)43(108-42(128)18-121)82(188-103)48(129)27(127)6-109/h26-41,43-101,109-121,126-127,129-157H,5-21H2,1-4H3,(H,104,122)(H,105,123)(H,106,124)(H,107,125)(H,108,128)(H,158,159)/t26-,27+,28+,29+,30+,31+,32+,33+,34+,35+,36+,37+,38+,39+,40+,41+,43+,44+,45+,46+,47+,48+,49+,50-,51+,52+,53+,54+,55+,56+,57+,58+,59+,60+,61-,62-,63-,64-,65-,66+,67+,68-,69+,70-,71+,72+,73-,74-,75-,76+,77+,78+,79+,80-,81-,82+,83-,84-,85-,86-,87-,88+,89-,90-,91-,92-,93-,94-,95+,96-,97-,98-,99+,100-,101+,103+/m0/s1
InChIKeyWTWVKSMRZHRDBH-PNYGMGBHSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:139426) is a N-glycan derivative (CHEBI:71275)
β-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:139426) is a amino oligosaccharide (CHEBI:22483)
β-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:139426) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
3,5-dideoxy-5-(2-hydroxyacetamido)-D-glycero-α-D-galacto-non-2-ulopyranonosyl-(2→3)-β-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)-[β-D-galactopyranosyl-(1→4)-β-D-galactopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)]-α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→6)]-α-D-mannopyranosyl-(1→6)]-β-D-mannopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
α-Neup5Gc-(2→3)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)-[β-D-Galp-(1→4)-β-D-Galp-(1→4)-β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)]-α-D-Manp-(1→3)-{α-D-Manp-(1→3)-[α-D-Manp-(1→6)]-α-D-Manp-(1→6)}-β-D-Manp-(1→4)-β-D-GlcpNAc-(1→4)-β-D-GlcpNAcChEBI
β-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-Neu5Gc-(2→3)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-α-D-Man-(1→3)-{α-D-Man-(1→3)-[α-D-Man-(1→6)]-α-D-Man-(1→6)}-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAcChEBI
α-Neu5Gc-(2→3)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→6)-[β-D-Gal-(1→4)-β-D-Gal-(1→4)-β-D-GlcNAc-(1→2)-α-D-Man-(1→3)]-α-D-Man-(1→3)-{α-D-Man-(1→3)-[α-D-Man-(1→6)]-α-D-Man-(1→6)}-β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-D-GlcNAcChEBI
α-N-glycoloylneuraminosyl-(2→3)-β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→6)-[β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→3)]-α-D-mannosyl-(1→3)-[α-D-mannosyl-(1→3)-[α-D-mannosyl-(1→6)]-α-D-mannosyl-(1→6)]-β-D-mannosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-β-D-glucosamineChEBI
α-N-glycoloylneuraminyl-(2→3)-β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→6)-[β-D-galactosyl-(1→4)-β-D-galactosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→3)]-α-D-mannosyl-(1→3)-[α-D-mannosyl-(1→3)-[α-D-mannosyl-(1→6)]-α-D-mannosyl-(1→6)]-β-D-mannosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-N-acetyl-β-D-glucosamineChEBI
Citations