EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:189563 - α-L-Fucp-(1→3)-[α-L-Fucp-(1→6)]-{β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)}-β-D-GlcpNAc

ChEBI IDCHEBI:189563
ChEBI Nameα-L-Fucp-(1→3)-[α-L-Fucp-(1→6)]-{β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)}-β-D-GlcpNAc
Stars
ASCII Namealpha-L-Fucp-(1->3)-[alpha-L-Fucp-(1->6)]-{beta-D-GlcpNAc-(1->2)-alpha-D-Manp-(1->3)-[alpha-D-Manp-(1->2)-alpha-D-Manp-(1->6)]-beta-D-Manp-(1->4)-beta-GlcpNAc-(1->4)}-beta-D-GlcpNAc
DefinitionA branched amino nonasaccharide derivative that is β-D-Man-(1→4)-β-D-GlcNAc-(1→4)-β-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→2)-α-D-Man group, while the GlcNAc residue at the reducing end also carries two Fuc residues attached via α-(1→3)- and α-(1→6)-linkages.
Last Modified20 February 2023
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC60H101N3O44
Net Charge0
Average Mass1568.445
Monoisotopic Mass1567.57579
SMILESCC(=O)N[C@@H]1[C@@H](O[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)[C@H](O[C@@H]2O[C@H](CO)[C@@H](O[C@@H]3O[C@H](CO[C@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]4O[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]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4NC(C)=O)[C@@H]3O)[C@H](O)[C@H]2NC(C)=O)[C@@H](CO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)O[C@H]1O
InChIInChI=1S/C60H101N3O44/c1-13-28(72)37(81)42(86)55(93-13)91-12-24-47(48(27(52(90)95-24)63-17(5)71)104-56-43(87)38(82)29(73)14(2)94-56)103-54-26(62-16(4)70)36(80)46(22(10-68)100-54)102-58-45(89)49(105-60-51(41(85)33(77)21(9-67)99-60)106-53-25(61-15(3)69)35(79)30(74)18(6-64)96-53)34(78)23(101-58)11-92-59-50(40(84)32(76)20(8-66)98-59)107-57-44(88)39(83)31(75)19(7-65)97-57/h13-14,18-60,64-68,72-90H,6-12H2,1-5H3,(H,61,69)(H,62,70)(H,63,71)/t13-,14-,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-,55+,56-,57+,58-,59-,60+/m0/s1
InChIKeyLKAHLEUZIJBADU-IDZILECDSA-N
ChEBI Ontology
Outgoing Relation(s)
α-L-Fucp-(1→3)-[α-L-Fucp-(1→6)]-{β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)}-β-D-GlcpNAc (CHEBI:189563) is a amino nonasaccharide (CHEBI:68818)
α-L-Fucp-(1→3)-[α-L-Fucp-(1→6)]-{β-D-GlcpNAc-(1→2)-α-D-Manp-(1→3)-[α-D-Manp-(1→2)-α-D-Manp-(1→6)]-β-D-Manp-(1→4)-β-GlcpNAc-(1→4)}-β-D-GlcpNAc (CHEBI:189563) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)]-β-D-mannopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-[α-L-fucopyranosyl-(1→3)]-[α-L-fucopyranosyl-(1→6)]-2-acetamido-2-deoxy-β-D-glucopyranose
Synonyms  Source
2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→2)-α-D-mannopyranosyl-(1→3)-[α-D-mannopyranosyl-(1→2)-α-D-mannopyranosyl-(1→6)]-β-D-mannopyranosyl-(1→4)-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→4)-[6-deoxy-α-L-galactopyranosyl-(1→3)]-[6-deoxy-α-L-galactopyranosyl-(1→6)]-2-acetamido-2-deoxy-β-D-glucopyranoseIUPAC
N-acetyl-β-D-glucosaminyl-(1→2)-α-D-mannosyl-(1→3)-[α-D-mannosyl-(1→2)-α-D-mannosyl-(1→6)]-β-D-mannosyl-(1→4)-N-acetyl-β-D-glucosaminyl-(1→4)-[α-L-fucosyl-(1→3)]-[α-L-fucosyl-(1→6)]-N-acetyl-β-D-glucosamineChEBI
Fucα1-3(Fucα1-6)[GlcNAcβ1-2Manα1-3(Manα1-2Manα1-6)Manβ1-4GlcNAcβ1-4]GlcNAcβIUPAC
β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-GlcNAc-(1→4)-[α-L-Fuc-(1→3)]-[α-L-Fuc-(1→6)]-D-GlcNAcIUPAC
α-L-Fuc-(1→3)-[α-L-Fuc-(1→6)]-{β-D-GlcNAc-(1→2)-α-D-Man-(1→3)-[α-D-Man-(1→2)-α-D-Man-(1→6)]-β-D-Man-(1→4)-β-GlcNAc-(1→4)}-β-D-GlcNAcChEBI
GlcNAcβ1-2Manα1-3(Manα1-2Manα1-6)Manβ1-4GlcNAcβ1-4(Fucα1-3)(Fucα1-6)GlcNAcβChEBI
Citations