CHEBI:77878 - β-D-GalNAc-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc(1→3)-β-D-Gal-(1→4)-D-Glc

ChEBI IDCHEBI:77878
ChEBI Nameβ-D-GalNAc-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc(1→3)-β-D-Gal-(1→4)-D-Glc
Stars
ASCII Namebeta-D-GalNAc-(1->4)-[alpha-L-Fuc-(1->3)]-beta-D-GlcNAc(1->3)-beta-D-Gal-(1->4)-D-Glc
DefinitionAn amino pentasaccharide consisting of a di-N-acetylated lactosediamine to which is linked (1→3) an α-L-fucosyl residue and which is in turn linked (1→3) to the galectose residue of a second lactose moiety. Saccharide portion of the antigen lacdiNAc fucopentaose-BSA.
Last Modified20 May 2020
SubmitterMarcus Ennis
DownloadsMolfile
FormulaC34H58N2O25
Net Charge0
Average Mass894.827
Monoisotopic Mass894.33287
SMILESCC(=O)N[C@H]1[C@H](O[C@H]2[C@H](O[C@@H]3O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]3O)[C@@H](NC(C)=O)[C@H](O[C@H]3[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]4[C@H](O)[C@@H](O)C(O)O[C@@H]4CO)[C@@H]3O)O[C@@H]2CO)O[C@H](CO)[C@H](O)[C@@H]1O
InChIInChI=1S/C34H58N2O25/c1-8-17(43)21(47)24(50)33(53-8)60-28-16(36-10(3)42)32(57-14(7-40)27(28)59-31-15(35-9(2)41)20(46)18(44)11(4-37)55-31)61-29-19(45)12(5-38)56-34(25(29)51)58-26-13(6-39)54-30(52)23(49)22(26)48/h8,11-34,37-40,43-52H,4-7H2,1-3H3,(H,35,41)(H,36,42)/t8-,11+,12+,13+,14+,15+,16+,17+,18-,19-,20+,21+,22+,23+,24-,25+,26+,27+,28+,29-,30?,31-,32-,33-,34-/m0/s1
InChIKeyUQYIBXYSFSUNBA-LBIKYFKZSA-N
ChEBI Ontology
Outgoing Relation(s)
β-D-GalNAc-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc(1→3)-β-D-Gal-(1→4)-D-Glc (CHEBI:77878) is a amino pentasaccharide (CHEBI:59268)
β-D-GalNAc-(1→4)-[α-L-Fuc-(1→3)]-β-D-GlcNAc(1→3)-β-D-Gal-(1→4)-D-Glc (CHEBI:77878) is a glucosamine oligosaccharide (CHEBI:22485)
IUPAC Name 
2-acetamido-2-deoxy-β-D-galactopyranosyl-(1→4)-[6-deoxy-α-L-galactopyranosyl-(1→3)]-2-acetamido-2-deoxy-β-D-glucopyranosyl-(1→3)-β-D-galactopyranosyl-(1→4)-D-glucopyranose
Synonyms  Source
lacdiNAc fucopentaoseChEBI
LDNFPChEBI
β-D-GalpNAc-(1→4)-[α-L-Fucp-(1→3)]-β-D-GlcpNAc(1→3)-β-D-Galp-(1→4)-D-GlcpIUPAC
N-acetyl-β-D-galactosaminyl-(1→4)-[α-L-fucosyl-(1→3)]-N-acetyl-β-D-glucosyl-(1→3)-β-D-galactosyl-(1→4)-D-glucopyranoseChEBI
Citations