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CHEBI:62295 - β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)-D-GlcpNAc

ChEBI IDCHEBI:62295
ChEBI Nameβ-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-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)-[beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-GlcpNAc-(1->4)-D-GlcpNAc
DefinitionAn amino heptasaccharide derivative that is β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-D-GlcNAc in which the mannosyl group is substituted at positions 3 and 6 by β-D-GlcNAc-(1→2)-α-D-Man groups.
Last Modified21 September 2021
SubmitterGareth Owen
DownloadsMolfile
FormulaC50H84N4O36
Net Charge0
Average Mass1317.214
Monoisotopic Mass1316.48653
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](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](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
WURCSWURCS=2.0/4,7,6/[a2122h-1x_1-5_2*NCC/3=O][a2122h-1b_1-5_2*NCC/3=O][a1122h-1b_1-5][a1122h-1a_1-5]/1-2-3-4-2-4-2/a4-b1_b4-c1_c3-d1_c6-f1_d2-e1_f2-g1
InChIInChI=1S/C50H84N4O36/c1-12(61)51-23-34(72)39(20(9-59)79-44(23)77)86-47-26(54-15(4)64)35(73)40(21(10-60)84-47)87-48-38(76)41(88-50-43(37(75)30(68)19(8-58)83-50)90-46-25(53-14(3)63)33(71)28(66)17(6-56)81-46)31(69)22(85-48)11-78-49-42(36(74)29(67)18(7-57)82-49)89-45-24(52-13(2)62)32(70)27(65)16(5-55)80-45/h16-50,55-60,65-77H,5-11H2,1-4H3,(H,51,61)(H,52,62)(H,53,63)(H,54,64)/t16-,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-/m1/s1
InChIKeyWYUKJASPBYYQRJ-LGLGTWNCSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:62295) is a amino heptasaccharide (CHEBI:70970)
β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:62295) is a glucosamine oligosaccharide (CHEBI:22485)
Incoming Relation(s)
β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)-β-D-GlcpNAc (CHEBI:71325) is a β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[β-D-GlcpNAc-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)-D-GlcpNAc (CHEBI:62295)
IUPAC Name 
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-[2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-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
β-N-acetyl-D-glucosamine-(1-2)-α-D-mannose-(1-3)-[β-N-acetyl-D-glucosamine-(1-2)-α-D-mannose-(1-6)]-β-D-mannose-(1-4)-β-N-acetyl-D-glucosamine-(1-4)-N-acetyl-D-glucosamineChEBI
2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-[2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)]-β-D-mannopyranosyl-(1→4)-2-(acetylamino)-2-deoxy-β-D-glucopyranosyl-(1→4)-2-(acetylamino)-2-deoxy-D-glucopyranoseIUPAC
β-N-acetyl-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→3)-[β-N-acetyl-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→6)]-β-D-mannosyl-(1→4)-β-N-acetyl-D-glucosaminyl-(1→4)-N-acetyl-D-glucosamineChEBI
β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[β-D-GlcNAc-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-GlcNAc-(1→4)-D-GlcNAcChEBI
β-N-acetyl-D-glucosamine-(1→2)-α-D-mannose-(1→3)-[β-N-acetyl-D-glucosamine-(1→2)-α-D-mannose-(1→6)]-β-D-mannose-(1→4)-β-N-acetyl-D-glucosamine-(1→4)-N-acetyl-D-glucosamineChEBI
(GlcNAc)4 (Man)3KEGG GLYCAN
Manual XrefsDatabases
G00388KEGG GLYCAN
G88876JQGlyTouCan
G88876JQGlyGen
Citations