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CHEBI:180550 - β-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-D-GlcpNAc

ChEBI IDCHEBI:180550
ChEBI Nameβ-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-D-GlcpNAc
Stars
ASCII Namebeta-D-GlcpNAc-(1->2)-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-GlcpNAc-(1->4)-D-GlcpNAc
DefinitionA branched amino octasaccharide derivative that is β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc in which the mannosyl group is substituted at position 3 by a β-D-GlcNAc-(1→2)-α-D-Man group and at position 6 by an α-D-Man-(1→3)-[α-D-Man-(1→6)]-α-D-Man group.
Last Modified26 September 2022
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC54H91N3O41
Net Charge0
Average Mass1438.302
Monoisotopic Mass1437.51280
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O)[C@@H](NC(C)=O)C(O)O[C@@H]2CO)O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO[C@H]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H](O)[C@H](O[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O)[C@@H]3O)[C@@H](O)[C@H](O[C@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]3O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)[C@@H]2O)[C@@H]1O
InChIInChI=1S/C54H91N3O41/c1-12(64)55-23-33(74)42(19(8-62)86-47(23)83)94-49-25(57-14(3)66)34(75)43(20(9-63)91-49)95-53-41(82)45(97-54-46(37(78)29(70)18(7-61)90-54)98-48-24(56-13(2)65)32(73)26(67)15(4-58)87-48)31(72)22(93-53)11-85-51-40(81)44(96-52-39(80)36(77)28(69)17(6-60)89-52)30(71)21(92-51)10-84-50-38(79)35(76)27(68)16(5-59)88-50/h15-54,58-63,67-83H,4-11H2,1-3H3,(H,55,64)(H,56,65)(H,57,66)/t15-,16-,17-,18-,19-,20-,21-,22-,23-,24-,25-,26-,27-,28-,29-,30-,31-,32-,33-,34-,35+,36+,37+,38+,39+,40+,41+,42-,43-,44+,45+,46+,47?,48+,49+,50+,51+,52-,53+,54-/m1/s1
InChIKeyMRIXKRYHOZQBAW-PYDYWRKSSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:180550) is a amino octasaccharide (CHEBI:71060)
β-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:180550) is a glucosamine oligosaccharide (CHEBI:22485)
Incoming Relation(s)
β-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:146850) is a β-D-GlcpNAc-(1→2)-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-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:180550)
IUPAC Name 
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-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-D-glucopyranose
Synonyms  Source
N-acetyl-β-D-glucosaminyl-(1→2)-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-D-glucosamineChEBI
β-D-GlcNAc-(1→2)-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-GlcNAc-(1→4)-D-GlcNAcChEBI
GlcNAcβ1-2Manα1-3[Manα1-3(Manα1-6)Manα1-6]Manβ1-4GlcNAcβ1-4GlcNAcIUPAC
Manual XrefsDatabases
G38297TUGlyGen
G38297TUGlyTouCan
Citations