Term: | alpha-Neup5Ac-(2->3)-beta-D-Galp-(1->3)-[beta-D-GlcpNAc-(1->6)]-alpha-D-GalpNAc |
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Accession: | CHEBI:180487
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Definition: | A branched amino tetrasaccharide comprising a linear trisaccharide chain of alpha-N-acetylneuraminyl, beta-D-galactosyl and N-acetyl-alpha-D-galactosamine residues linked sequentially (2->3) and (1->3), to the N-acetyl-alpha-D-galactosamine residue at the reducing end of which is also linked (1->6) an N-acetyl-beta-D-glucosamine residue. |
Synonyms: | exact_synonym: | 2-acetamido-2-deoxy-beta-D-glucopyranosyl-(1->6)-[5-acetamido-3,5-dideoxy-D-glycero-alpha-D-galacto-non-2-ulopyranonosyl-(2->3)-beta-D-galactopyranosyl-(1->3)]-2-acetamido-2-deoxy-alpha-D-galactopyranose |
| related_synonym: | Formula=C33H55N3O24; GlcNAcb1-6(Neu5Aca2-3Galb1-3)GalNAca; GlcNAcbeta1-6(Neu5Acalpha2-3Galbeta1-3)GalNAcalpha; InChI=1S/C33H55N3O24/c1-9(40)34-17-12(43)4-33(32(52)53,59-27(17)20(45)13(44)5-37)60-28-22(47)15(7-39)57-31(25(28)50)58-26-19(36-11(3)42)29(51)55-16(23(26)48)8-54-30-18(35-10(2)41)24(49)21(46)14(6-38)56-30/h12-31,37-39,43-51H,4-8H2,1-3H3,(H,34,40)(H,35,41)(H,36,42)(H,52,53)/t12-,13+,14+,15+,16+,17+,18+,19+,20+,21+,22-,23-,24+,25+,26+,27+,28-,29-,30+,31-,33-/m0/s1; InChIKey=HQAKEQYJAQRGME-FBDVBGJUSA-N; N-acetyl-alpha-neuraminyl-(2->3)-beta-D-galactosyl-(1->3)-[N-acetyl-beta-D-glucosaminyl-(1->6)]-N-acetyl-alpha-D-galactosamine; SMILES=[H][C@]1(O[C@@](C[C@H](O)[C@H]1NC(C)=O)(O[C@H]1[C@@H](O)[C@@H](CO)O[C@@H](O[C@H]2[C@@H](O)[C@@H](CO[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3NC(C)=O)O[C@H](O)[C@@H]2NC(C)=O)[C@@H]1O)C(O)=O)[C@H](O)[C@H](O)CO |
| xref: | PMID:31537530 |
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