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CHEBI:85047 - α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-α-L-Fucp-(1→3)-D-Glcp

ChEBI IDCHEBI:85047
ChEBI Nameα-Neup5Ac-(2→3)-β-D-Galp-(1→4)-α-L-Fucp-(1→3)-D-Glcp
Stars
ASCII Namealpha-Neup5Ac-(2->3)-beta-D-Galp-(1->4)-alpha-L-Fucp-(1->3)-D-Glcp
DefinitionAn amino tetrasaccharide comprising α-N-acetylneuraminyl, β-D-galactosyl, D-glucopyranosyl and α-L-fucosyl residue.
Last Modified26 April 2021
Submitternamrata
DownloadsMolfile
FormulaC29H49NO23
Net Charge0
Average Mass779.695
Monoisotopic Mass779.26954
SMILES[H][C@@]1([C@H](O)[C@H](O)CO)O[C@@](O[C@H]2[C@@H](O)[C@@H](CO)O[C@@H](O[C@@H]3[C@H](O)[C@@H](O)[C@@H](O[C@H]4[C@H](O)[C@@H](CO)OC(O)[C@@H]4O)O[C@@H]3C)[C@@H]2O)(C(=O)O)C[C@H](O)[C@H]1NC(C)=O
InChIInChI=1S/C29H49NO23/c1-7-21(17(40)18(41)26(47-7)51-23-15(38)11(5-32)48-25(44)19(23)42)50-27-20(43)24(16(39)12(6-33)49-27)53-29(28(45)46)3-9(35)13(30-8(2)34)22(52-29)14(37)10(36)4-31/h7,9-27,31-33,35-44H,3-6H2,1-2H3,(H,30,34)(H,45,46)/t7-,9+,10-,11-,12-,13-,14-,15-,16+,17-,18-,19-,20-,21+,22-,23+,24+,25?,26-,27+,29+/m1/s1
InChIKeyAWWBSTXOEBZVKE-HXVWDDMWSA-N
ChEBI Ontology
Outgoing Relation(s)
α-Neup5Ac-(2→3)-β-D-Galp-(1→4)-α-L-Fucp-(1→3)-D-Glcp (CHEBI:85047) is a amino tetrasaccharide (CHEBI:59412)
IUPAC Name 
(6R)-5-(acetylamino)-3,5-dideoxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]-β-L-threo-hex-2-ulopyranonosyl-(2→3)-β-D-galactopyranosyl-(1→4)-6-deoxy-α-D-galactopyranosyl-(1→3)-D-glucopyranose